Chem
J-GLOBAL ID:200907081824406421
Nikkaji number:J1.099.160I
LU-53439
3,4-ジメチル-7-[(5-イソプロピル-1,3,4-チアジアゾール-2-イル)メトキシ]-2H-1-ベンゾピラン-2-オン
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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:
C17 H18 N2 O3 S
Molecular formula furigana:
C17-H18-N2-O3-S
Molecular weight:
330.400
InChI:
InChI=1S/C17H18N2O3S/c1-9(2)16-19-18-15(23-16)8-21-12-5-6-13-10(3)11(4)17(20)22-14(13)7-12/h5-7,9H,8H2,1-4H3
InChI key:
HQTNJPCZUQAYAB-UHFFFAOYSA-N
SMILES:
CC(C)c1nnc(COc2ccc3c(C)c(C)c(=O)oc3c2)s1
Systematic name (3):
3,4-ジメチル-7-[(5-イソプロピル-1,3,4-チアジアゾール-2-イル)メトキシ]-2H-1-ベンゾピラン-2-オン
3,4-ジメチル-7-{[5-(プロパン-2-イル)-1,3,4-チアジアゾール-2-イル]メトキシ}-2H-クロメン-2-オン
3,4-dimethyl-7-{[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]methoxy}-2H-chromen-2-one
Other name (2):
3,4-Dimethyl-7-[(5-isopropyl-1,3,4-thiadiazole-2-yl)methoxy]-2H-1-benzopyran-2-one
LU-53439
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