Chem
J-GLOBAL ID:200907055398277987
Nikkaji number:J761.720H
SNC-67
4-[(S)-α-[2α,5β-ジメチル-4-(2-プロペニル)ピペラジン-1-イル]-3-メトキシベンジル]-N,N-ジエチルベンズアミド
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C28 H39 N3 O2
Molecular formula furigana:
C28-H39-N3-O2
Molecular weight:
449.639
InChI:
InChI=1S/C28H39N3O2/c1-7-17-30-19-22(5)31(20-21(30)4)27(25-11-10-12-26(18-25)33-6)23-13-15-24(16-14-23)28(32)29(8-2)9-3/h7,10-16,18,21-22,27H,1,8-9,17,19-20H2,2-6H3/t21-,22+,27-/m0/s1
InChI key:
KQWVAUSXZDRQPZ-XXAUWVGASA-N
SMILES:
CCN(CC)C(=O)c1ccc(cc1)[C@H](N1C[C@H](C)N(CC=C)C[C@H]1C)c1cccc(OC)c1
Systematic name (3):
4-[(S)-α-[2α,5β-ジメチル-4-(2-プロペニル)ピペラジン-1-イル]-3-メトキシベンジル]-N,N-ジエチルベンズアミド
4-[(S)-[(2R,5S)-2,5-ジメチル-4-(プロパ-2-エン-1-イル)ピペラジン-1-イル](3-メトキシフェニル)メチル]-N,N-ジエチルベンズアミド
4-[(S)-[(2R,5S)-2,5-dimethyl-4-(prop-2-en-1-yl)piperazin-1-yl](3-methoxyphenyl)methyl]-N,N-diethylbenzamide
Other name (2):
SNC-67
4-[(S)-α-[2α,5β-Dimethyl-4-(2-propenyl)piperazin-1-yl]-3-methoxybenzyl]-N,N-diethylbenzamide
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