N-[4-(3-chloranyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carboxamide

Systemtic Name: N-[4-(3-chloranyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carboxamide Openeye Name: 1-benzyl-N-[4-(3-chloro-4-methoxy-phenyl)thiazol-2-yl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[4-(3-chloro-4-methoxyphenyl)-2-thiazolyl]-5-oxo-1-(phenylmethyl)-3-pyrrolidinecarboxamide IUPAC Name: 1-benzyl-N-[4-(3-chloro-4-methoxyphenyl)-1,3-thiazol-2-yl]-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-benzyl-N-[4-(3-chloro-4-methoxy-phenyl)thiazol-2-yl]-5-keto-pyrrolidine-3-carboxamide Formula: C22H20ClN3O3S MolecularWeight: 441.9305

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3CC(=O)N(C3)CC4=CC=CC=C4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3CC(=O)N(C3)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C22H20ClN3O3S/c1-29-19-8-7-15(9-17(19)23)18-13-30-22(24-18)25-21(28)16-10-20(27)26(12-16)11-14-5-3-2-4-6-14/h2-9,13,16H,10-12H2,1H3,(H,24,25,28)