[(4-methoxyphenyl)methylsulfanyl-(2-methylpropyl)carbamoyl] 4-cyano-1,3-thiazolidine-3-carboxylate

Systemtic Name: [(4-methoxyphenyl)methylsulfanyl-(2-methylpropyl)carbamoyl] 4-cyano-1,3-thiazolidine-3-carboxylate Openeye Name: [isobutyl-[(4-methoxyphenyl)methylsulfanyl]carbamoyl] 4-cyanothiazolidine-3-carboxylate CAS Name: 4-cyano-3-thiazolidinecarboxylic acid [[[(4-methoxyphenyl)methylthio]-(2-methylpropyl)amino]-oxomethyl] ester IUPAC Name: [(4-methoxyphenyl)methylsulfanyl-(2-methylpropyl)carbamoyl] 4-cyano-1,3-thiazolidine-3-carboxylate Traditional Name: 4-cyanothiazolidine-3-carboxylic acid [isobutyl-(p-anisylthio)carbamoyl] ester Formula: C18H23N3O4S2 MolecularWeight: 409.52292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C(=O)OC(=O)N1CSCC1C#N)SCC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)CN(C(=O)OC(=O)N1CSCC1C#N)SCC2=CC=C(C=C2)OC

InChI

InChI=1S/C18H23N3O4S2/c1-13(2)9-21(27-10-14-4-6-16(24-3)7-5-14)18(23)25-17(22)20-12-26-11-15(20)8-19/h4-7,13,15H,9-12H2,1-3H3