7-methyl-5-phenyl-9-propylsulfonyl-3H-1,4-benzodiazepin-2-amine

Systemtic Name: 7-methyl-5-phenyl-9-propylsulfonyl-3H-1,4-benzodiazepin-2-amine Openeye Name: 7-methyl-5-phenyl-9-propylsulfonyl-3H-1,4-benzodiazepin-2-amine CAS Name: 7-methyl-5-phenyl-9-propylsulfonyl-3H-1,4-benzodiazepin-2-amine IUPAC Name: 7-methyl-5-phenyl-9-propylsulfonyl-3H-1,4-benzodiazepin-2-amine Traditional Name: (7-methyl-5-phenyl-9-propylsulfonyl-3H-1,4-benzodiazepin-2-yl)amine Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=C2C(=CC(=C1)C)C(=NCC(=N2)N)C3=CC=CC=C3

Isomeric SMILES

CCCS(=O)(=O)C1=C2C(=CC(=C1)C)C(=NCC(=N2)N)C3=CC=CC=C3

InChI

InChI=1S/C19H21N3O2S/c1-3-9-25(23,24)16-11-13(2)10-15-18(14-7-5-4-6-8-14)21-12-17(20)22-19(15)16/h4-8,10-11H,3,9,12H2,1-2H3,(H2,20,22)