9-[di(propan-2-yl)amino]-7-methyl-5-(3-propylsulfonylphenyl)-1,3-dihydro-1,4-benzodiazepine-2-thione

Systemtic Name: 9-[di(propan-2-yl)amino]-7-methyl-5-(3-propylsulfonylphenyl)-1,3-dihydro-1,4-benzodiazepine-2-thione Openeye Name: 9-(diisopropylamino)-7-methyl-5-(3-propylsulfonylphenyl)-1,3-dihydro-1,4-benzodiazepine-2-thione CAS Name: 9-[di(propan-2-yl)amino]-7-methyl-5-(3-propylsulfonylphenyl)-1,3-dihydro-1,4-benzodiazepine-2-thione IUPAC Name: 9-[di(propan-2-yl)amino]-7-methyl-5-(3-propylsulfonylphenyl)-1,3-dihydro-1,4-benzodiazepine-2-thione Traditional Name: 9-(diisopropylamino)-7-methyl-5-(3-propylsulfonylphenyl)-1,3-dihydro-1,4-benzodiazepine-2-thione Formula: C25H33N3O2S2 MolecularWeight: 471.67842

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=CC=CC(=C1)C2=NCC(=S)NC3=C(C=C(C=C32)C)N(C(C)C)C(C)C

Isomeric SMILES

CCCS(=O)(=O)C1=CC=CC(=C1)C2=NCC(=S)NC3=C(C=C(C=C32)C)N(C(C)C)C(C)C

InChI

InChI=1S/C25H33N3O2S2/c1-7-11-32(29,30)20-10-8-9-19(14-20)24-21-12-18(6)13-22(28(16(2)3)17(4)5)25(21)27-23(31)15-26-24/h8-10,12-14,16-17H,7,11,15H2,1-6H3,(H,27,31)