[1-[(2-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-naphthalen-2-ylsulfanylethanoate

Systemtic Name: [1-[(2-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl] 2-naphthalen-2-ylsulfanylethanoate Openeye Name: [2-(2-chloroanilino)-1-methyl-2-oxo-ethyl] 2-(2-naphthylsulfanyl)acetate CAS Name: 2-(2-naphthalenylthio)acetic acid [1-(2-chloroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-chloroanilino)-1-oxopropan-2-yl] 2-naphthalen-2-ylsulfanylacetate Traditional Name: 2-(2-naphthylthio)acetic acid [2-(2-chloroanilino)-2-keto-1-methyl-ethyl] ester Formula: C21H18ClNO3S MolecularWeight: 399.89052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1Cl)OC(=O)CSC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1Cl)OC(=O)CSC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H18ClNO3S/c1-14(21(25)23-19-9-5-4-8-18(19)22)26-20(24)13-27-17-11-10-15-6-2-3-7-16(15)12-17/h2-12,14H,13H2,1H3,(H,23,25)