[2-[(diphenylmethyl)amino]-2-oxidanylidene-ethyl] 2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoate

Systemtic Name: [2-[(diphenylmethyl)amino]-2-oxidanylidene-ethyl] 2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoate Openeye Name: [2-(benzhydrylamino)-2-oxo-ethyl] 2-(4-bromo-2-methyl-phenyl)sulfanylacetate CAS Name: 2-[(4-bromo-2-methylphenyl)thio]acetic acid [2-[(diphenylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-(benzhydrylamino)-2-oxoethyl] 2-(4-bromo-2-methylphenyl)sulfanylacetate Traditional Name: 2-[(4-bromo-2-methyl-phenyl)thio]acetic acid [2-(benzhydrylamino)-2-keto-ethyl] ester Formula: C24H22BrNO3S MolecularWeight: 484.40538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)SCC(=O)OCC(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)SCC(=O)OCC(=O)NC(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H22BrNO3S/c1-17-14-20(25)12-13-21(17)30-16-23(28)29-15-22(27)26-24(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-14,24H,15-16H2,1H3,(H,26,27)