ethyl 4-[2-[(4-bromophenyl)methylsulfanyl]ethanoylamino]-3-chloranyl-benzoate

Systemtic Name: ethyl 4-[2-[(4-bromophenyl)methylsulfanyl]ethanoylamino]-3-chloranyl-benzoate Openeye Name: ethyl 4-[[2-[(4-bromophenyl)methylsulfanyl]acetyl]amino]-3-chloro-benzoate CAS Name: 4-[[2-[(4-bromophenyl)methylthio]-1-oxoethyl]amino]-3-chlorobenzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(4-bromophenyl)methylsulfanyl]acetyl]amino]-3-chlorobenzoate Traditional Name: 4-[[2-[(4-bromobenzyl)thio]acetyl]amino]-3-chloro-benzoic acid ethyl ester Formula: C18H17BrClNO3S MolecularWeight: 442.75448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC(=O)CSCC2=CC=C(C=C2)Br)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC(=O)CSCC2=CC=C(C=C2)Br)Cl

InChI

InChI=1S/C18H17BrClNO3S/c1-2-24-18(23)13-5-8-16(15(20)9-13)21-17(22)11-25-10-12-3-6-14(19)7-4-12/h3-9H,2,10-11H2,1H3,(H,21,22)