4-cyclohexyl-2-methylidene-1-(4-methylphenyl)sulfonyl-3H-1,4-benzodiazepin-5-one

Systemtic Name: 4-cyclohexyl-2-methylidene-1-(4-methylphenyl)sulfonyl-3H-1,4-benzodiazepin-5-one Openeye Name: 4-cyclohexyl-2-methylene-1-(p-tolylsulfonyl)-3H-1,4-benzodiazepin-5-one CAS Name: 4-cyclohexyl-2-methylene-1-(4-methylphenyl)sulfonyl-3H-1,4-benzodiazepin-5-one IUPAC Name: 4-cyclohexyl-2-methylidene-1-(4-methylphenyl)sulfonyl-3H-1,4-benzodiazepin-5-one Traditional Name: 4-cyclohexyl-2-methylene-1-tosyl-3H-1,4-benzodiazepin-5-one Formula: C23H26N2O3S MolecularWeight: 410.52914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(=C)CN(C(=O)C3=CC=CC=C32)C4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=C)CN(C(=O)C3=CC=CC=C32)C4CCCCC4

InChI

InChI=1S/C23H26N2O3S/c1-17-12-14-20(15-13-17)29(27,28)25-18(2)16-24(19-8-4-3-5-9-19)23(26)21-10-6-7-11-22(21)25/h6-7,10-15,19H,2-5,8-9,16H2,1H3