methyl 2-[3-[2-(4-chlorophenyl)sulfanylethylamino]-3-oxidanylidene-propyl]sulfanylbenzoate

Systemtic Name: methyl 2-[3-[2-(4-chlorophenyl)sulfanylethylamino]-3-oxidanylidene-propyl]sulfanylbenzoate Openeye Name: methyl 2-[3-[2-(4-chlorophenyl)sulfanylethylamino]-3-oxo-propyl]sulfanylbenzoate CAS Name: 2-[[3-[2-[(4-chlorophenyl)thio]ethylamino]-3-oxopropyl]thio]benzoic acid methyl ester IUPAC Name: methyl 2-[3-[2-(4-chlorophenyl)sulfanylethylamino]-3-oxopropyl]sulfanylbenzoate Traditional Name: 2-[[3-[2-[(4-chlorophenyl)thio]ethylamino]-3-keto-propyl]thio]benzoic acid methyl ester Formula: C19H20ClNO3S2 MolecularWeight: 409.95

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1SCCC(=O)NCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)C1=CC=CC=C1SCCC(=O)NCCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H20ClNO3S2/c1-24-19(23)16-4-2-3-5-17(16)26-12-10-18(22)21-11-13-25-15-8-6-14(20)7-9-15/h2-9H,10-13H2,1H3,(H,21,22)