Chem
J-GLOBAL ID:200907055747824397
Nikkaji number:J33.154F
Devapamil
デバパミル
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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:
C26 H36 N2 O3
Molecular formula furigana:
C26-H36-N2-O3
Molecular weight:
424.585
InChI:
InChI=1S/C26H36N2O3/c1-20(2)26(19-27,22-11-12-24(30-5)25(18-22)31-6)14-8-15-28(3)16-13-21-9-7-10-23(17-21)29-4/h7,9-12,17-18,20H,8,13-16H2,1-6H3
InChI key:
VMVKIDPOEOLUFS-UHFFFAOYSA-N
SMILES:
COc1cccc(CCN(C)CCCC(C#N)(C(C)C)c2ccc(OC)c(OC)c2)c1
Systematic name (3):
2-(3,4-ジメトキシフェニル)-2-イソプロピル-5-[[2-(3-メトキシフェニル)エチル]メチルアミノ]バレロニトリル
2-(3,4-ジメトキシフェニル)-5-{[2-(3-メトキシフェニル)エチル](メチル)アミノ}-2-(プロパン-2-イル)ペンタンニトリル
2-(3,4-dimethoxyphenyl)-5-{[2-(3-methoxyphenyl)ethyl](methyl)amino}-2-(propan-2-yl)pentanenitrile
Other name (3):
デバパミル
Devapamil
2-(3,4-Dimethoxyphenyl)-2-isopropyl-5-[[2-(3-methoxyphenyl)ethyl]methylamino]valeronitrile
CAS registry number:
92302-55-1
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