1,5-bis-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-1,5-benzodiazepin-7-amine

Systemtic Name: 1,5-bis-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-1,5-benzodiazepin-7-amine Openeye Name: 1,5-bis(p-tolylsulfonyl)-3,4-dihydro-2H-1,5-benzodiazepin-7-amine CAS Name: 1,5-bis-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-1,5-benzodiazepin-7-amine IUPAC Name: 1,5-bis-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-1,5-benzodiazepin-7-amine Traditional Name: (1,5-ditosyl-3,4-dihydro-2H-1,5-benzodiazepin-7-yl)amine Formula: C23H25N3O4S2 MolecularWeight: 471.5923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(C3=C2C=CC(=C3)N)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(C3=C2C=CC(=C3)N)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C23H25N3O4S2/c1-17-4-9-20(10-5-17)31(27,28)25-14-3-15-26(23-16-19(24)8-13-22(23)25)32(29,30)21-11-6-18(2)7-12-21/h4-13,16H,3,14-15,24H2,1-2H3