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

Systemtic Name: (3S)-3-methyl-4-(3-methylbut-2-enyl)-3,5-dihydro-2H-1,4-benzodiazepine-1-carbothioamide Openeye Name: (3S)-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)-3,5-dihydro-2H-1,4-benzodiazepine-1-carbothioamide IUPAC Name: (3S)-3-methyl-4-(3-methylbut-2-enyl)-3,5-dihydro-2H-1,4-benzodiazepine-1-carbothioamide Traditional Name: (3S)-3-methyl-4-(3-methylbut-2-enyl)-3,5-dihydro-2H-1,4-benzodiazepine-1-carbothioamide Formula: C16H23N3S MolecularWeight: 289.43892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3S/c1-12(2)8-9-18-11-14-6-4-5-7-15(14)19(16(17)20)10-13(18)3/h4-8,13H,9-11H2,1-3H3,(H2,17,20)/t13-/m0/s1