(5S)-N'-(3-cyanophenyl)carbonyl-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide

Systemtic Name: (5S)-N'-(3-cyanophenyl)carbonyl-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Openeye Name: (5S)-N'-(3-cyanobenzoyl)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide CAS Name: (5S)-N'-[(3-cyanophenyl)-oxomethyl]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide IUPAC Name: (5S)-N'-(3-cyanobenzoyl)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbohydrazide Traditional Name: (5S)-N'-(3-cyanobenzoyl)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbohydrazide Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C[C@H]1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H17N3O2S/c1-11-5-6-15-14(7-11)9-16(24-15)18(23)21-20-17(22)13-4-2-3-12(8-13)10-19/h2-4,8-9,11H,5-7H2,1H3,(H,20,22)(H,21,23)/t11-/m0/s1