methyl 3-[2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-[(5-chloro-2-thienyl)methylsulfanyl]acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[(5-chloro-2-thiophenyl)methylthio]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[(5-chlorothiophen-2-yl)methylsulfanyl]acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[(5-chloro-2-thienyl)methylthio]acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C16H16ClNO3S2 MolecularWeight: 369.88614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSCC2=CC=C(S2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CSCC2=CC=C(S2)Cl

InChI

InChI=1S/C16H16ClNO3S2/c1-10-3-4-11(16(20)21-2)7-13(10)18-15(19)9-22-8-12-5-6-14(17)23-12/h3-7H,8-9H2,1-2H3,(H,18,19)