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

Systemtic Name: (3S)-N-tert-butyl-3-methyl-4-(3-methylbut-2-enyl)-3,5-dihydro-2H-1,4-benzodiazepine-1-carbothioamide Openeye Name: (3S)-N-tert-butyl-3-methyl-4-(3-methylbut-2-enyl)-3,5-dihydro-2H-1,4-benzodiazepine-1-carbothioamide CAS Name: (3S)-N-tert-butyl-3-methyl-4-(3-methylbut-2-enyl)-3,5-dihydro-2H-1,4-benzodiazepine-1-carbothioamide IUPAC Name: (3S)-N-tert-butyl-3-methyl-4-(3-methylbut-2-enyl)-3,5-dihydro-2H-1,4-benzodiazepine-1-carbothioamide Traditional Name: (3S)-N-tert-butyl-3-methyl-4-(3-methylbut-2-enyl)-3,5-dihydro-2H-1,4-benzodiazepine-1-carbothioamide Formula: C20H31N3S MolecularWeight: 345.54524

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=CC=CC=C2CN1CC=C(C)C)C(=S)NC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C20H31N3S/c1-15(2)11-12-22-14-17-9-7-8-10-18(17)23(13-16(22)3)19(24)21-20(4,5)6/h7-11,16H,12-14H2,1-6H3,(H,21,24)/t16-/m0/s1