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

Systemtic Name: 4-cyclopentyl-2-methylidene-1-(4-methylphenyl)sulfonyl-3H-1,4-benzodiazepin-5-one Openeye Name: 4-cyclopentyl-2-methylene-1-(p-tolylsulfonyl)-3H-1,4-benzodiazepin-5-one CAS Name: 4-cyclopentyl-2-methylene-1-(4-methylphenyl)sulfonyl-3H-1,4-benzodiazepin-5-one IUPAC Name: 4-cyclopentyl-2-methylidene-1-(4-methylphenyl)sulfonyl-3H-1,4-benzodiazepin-5-one Traditional Name: 4-cyclopentyl-2-methylene-1-tosyl-3H-1,4-benzodiazepin-5-one Formula: C22H24N2O3S MolecularWeight: 396.50256

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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)C4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(=C)CN(C(=O)C3=CC=CC=C32)C4CCCC4

InChI

InChI=1S/C22H24N2O3S/c1-16-11-13-19(14-12-16)28(26,27)24-17(2)15-23(18-7-3-4-8-18)22(25)20-9-5-6-10-21(20)24/h5-6,9-14,18H,2-4,7-8,15H2,1H3