[2-[[4-(4-bromophenyl)sulfanylphenyl]amino]-2-oxidanylidene-ethyl] butanoate

Systemtic Name: [2-[[4-(4-bromophenyl)sulfanylphenyl]amino]-2-oxidanylidene-ethyl] butanoate Openeye Name: [2-[4-(4-bromophenyl)sulfanylanilino]-2-oxo-ethyl] butanoate CAS Name: butanoic acid [2-[4-[(4-bromophenyl)thio]anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(4-bromophenyl)sulfanylanilino]-2-oxoethyl] butanoate Traditional Name: butyric acid [2-[4-[(4-bromophenyl)thio]anilino]-2-keto-ethyl] ester Formula: C18H18BrNO3S MolecularWeight: 408.30942

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC(=O)NC1=CC=C(C=C1)SC2=CC=C(C=C2)Br

Isomeric SMILES

CCCC(=O)OCC(=O)NC1=CC=C(C=C1)SC2=CC=C(C=C2)Br

InChI

InChI=1S/C18H18BrNO3S/c1-2-3-18(22)23-12-17(21)20-14-6-10-16(11-7-14)24-15-8-4-13(19)5-9-15/h4-11H,2-3,12H2,1H3,(H,20,21)