S-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl] 3-chloranyl-1-benzothiophene-2-carbothioate

Systemtic Name: S-[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl] 3-chloranyl-1-benzothiophene-2-carbothioate Openeye Name: S-[2-(4-methoxyanilino)-2-oxo-ethyl] 3-chlorobenzothiophene-2-carbothioate CAS Name: 3-chloro-1-benzothiophene-2-carbothioic acid S-[2-(4-methoxyanilino)-2-oxoethyl] ester IUPAC Name: S-[2-(4-methoxyanilino)-2-oxoethyl] 3-chloro-1-benzothiophene-2-carbothioate Traditional Name: 3-chlorobenzothiophene-2-carbothioic acid S-[2-keto-2-(p-anisidino)ethyl] ester Formula: C18H14ClNO3S2 MolecularWeight: 391.89166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CSC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CSC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C18H14ClNO3S2/c1-23-12-8-6-11(7-9-12)20-15(21)10-24-18(22)17-16(19)13-4-2-3-5-14(13)25-17/h2-9H,10H2,1H3,(H,20,21)