1-(3-chloranyl-4-methyl-phenyl)-5-oxidanylidene-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)pyrrolidine-3-carboxamide

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-5-oxidanylidene-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)pyrrolidine-3-carboxamide Openeye Name: 1-(3-chloro-4-methyl-phenyl)-5-oxo-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)pyrrolidine-3-carboxamide CAS Name: 1-(3-chloro-4-methylphenyl)-5-oxo-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)-3-pyrrolidinecarboxamide IUPAC Name: 1-(3-chloro-4-methylphenyl)-5-oxo-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)pyrrolidine-3-carboxamide Traditional Name: 1-(3-chloro-4-methyl-phenyl)-5-keto-N-(5-phenethyl-1,3,4-thiadiazol-2-yl)pyrrolidine-3-carboxamide Formula: C22H21ClN4O2S MolecularWeight: 440.94574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)NC3=NN=C(S3)CCC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2CC(CC2=O)C(=O)NC3=NN=C(S3)CCC4=CC=CC=C4)Cl

InChI

InChI=1S/C22H21ClN4O2S/c1-14-7-9-17(12-18(14)23)27-13-16(11-20(27)28)21(29)24-22-26-25-19(30-22)10-8-15-5-3-2-4-6-15/h2-7,9,12,16H,8,10-11,13H2,1H3,(H,24,26,29)