(3S)-3-methyl-4-(3-methylbut-2-enyl)-N-(phenylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-1-carbothioamide

Systemtic Name: (3S)-3-methyl-4-(3-methylbut-2-enyl)-N-(phenylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-1-carbothioamide Openeye Name: (3S)-N-benzyl-3-methyl-4-(3-methylbut-2-enyl)-3,5-dihydro-2H-1,4-benzodiazepine-1-carbothioamide CAS Name: (3S)-3-methyl-4-(3-methylbut-2-enyl)-N-(phenylmethyl)-3,5-dihydro-2H-1,4-benzodiazepine-1-carbothioamide IUPAC Name: (3S)-N-benzyl-3-methyl-4-(3-methylbut-2-enyl)-3,5-dihydro-2H-1,4-benzodiazepine-1-carbothioamide Traditional Name: (3S)-N-benzyl-3-methyl-4-(3-methylbut-2-enyl)-3,5-dihydro-2H-1,4-benzodiazepine-1-carbothioamide Formula: C23H29N3S MolecularWeight: 379.56146

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=CC=CC=C2CN1CC=C(C)C)C(=S)NCC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CN(C2=CC=CC=C2CN1CC=C(C)C)C(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C23H29N3S/c1-18(2)13-14-25-17-21-11-7-8-12-22(21)26(16-19(25)3)23(27)24-15-20-9-5-4-6-10-20/h4-13,19H,14-17H2,1-3H3,(H,24,27)/t19-/m0/s1