S-[2-[[2-chloranyl-4-(methylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl] N-methyl-N-naphthalen-1-yl-carbamothioate

Systemtic Name: S-[2-[[2-chloranyl-4-(methylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl] N-methyl-N-naphthalen-1-yl-carbamothioate Openeye Name: S-[2-[2-chloro-4-(methylcarbamoyl)anilino]-2-oxo-ethyl] N-methyl-N-(1-naphthyl)carbamothioate CAS Name: N-methyl-N-(1-naphthalenyl)carbamothioic acid S-[2-[2-chloro-4-(methylcarbamoyl)anilino]-2-oxoethyl] ester IUPAC Name: S-[2-[2-chloro-4-(methylcarbamoyl)anilino]-2-oxoethyl] N-methyl-N-naphthalen-1-ylcarbamothioate Traditional Name: N-methyl-N-(1-naphthyl)thiocarbamic acid S-[2-[2-chloro-4-(methylcarbamoyl)anilino]-2-keto-ethyl] ester Formula: C22H20ClN3O3S MolecularWeight: 441.9305

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=C(C=C1)NC(=O)CSC(=O)N(C)C2=CC=CC3=CC=CC=C32)Cl

Isomeric SMILES

CNC(=O)C1=CC(=C(C=C1)NC(=O)CSC(=O)N(C)C2=CC=CC3=CC=CC=C32)Cl

InChI

InChI=1S/C22H20ClN3O3S/c1-24-21(28)15-10-11-18(17(23)12-15)25-20(27)13-30-22(29)26(2)19-9-5-7-14-6-3-4-8-16(14)19/h3-12H,13H2,1-2H3,(H,24,28)(H,25,27)