N-(3-chloranyl-2-pyrrolidin-1-yl-phenyl)-2-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(3-chloranyl-2-pyrrolidin-1-yl-phenyl)-2-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]sulfanyl]ethanamide Openeye Name: N-(3-chloro-2-pyrrolidin-1-yl-phenyl)-2-[4-(p-tolyl)thiazol-2-yl]sulfanyl-acetamide CAS Name: N-[3-chloro-2-(1-pyrrolidinyl)phenyl]-2-[[4-(4-methylphenyl)-2-thiazolyl]thio]acetamide IUPAC Name: N-(3-chloro-2-pyrrolidin-1-ylphenyl)-2-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]sulfanyl]acetamide Traditional Name: N-(3-chloro-2-pyrrolidino-phenyl)-2-[[4-(p-tolyl)thiazol-2-yl]thio]acetamide Formula: C22H22ClN3OS2 MolecularWeight: 444.01258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)SCC(=O)NC3=C(C(=CC=C3)Cl)N4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)SCC(=O)NC3=C(C(=CC=C3)Cl)N4CCCC4

InChI

InChI=1S/C22H22ClN3OS2/c1-15-7-9-16(10-8-15)19-13-28-22(25-19)29-14-20(27)24-18-6-4-5-17(23)21(18)26-11-2-3-12-26/h4-10,13H,2-3,11-12,14H2,1H3,(H,24,27)