(2-phenylazanyl-1,3-thiazol-4-yl)methyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate

Systemtic Name: (2-phenylazanyl-1,3-thiazol-4-yl)methyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate Openeye Name: (2-anilinothiazol-4-yl)methyl 1-(4-chlorophenyl)cyclopentanecarboxylate CAS Name: 1-(4-chlorophenyl)-1-cyclopentanecarboxylic acid (2-anilino-4-thiazolyl)methyl ester IUPAC Name: (2-anilino-1,3-thiazol-4-yl)methyl 1-(4-chlorophenyl)cyclopentane-1-carboxylate Traditional Name: 1-(4-chlorophenyl)cyclopentanecarboxylic acid (2-anilinothiazol-4-yl)methyl ester Formula: C22H21ClN2O2S MolecularWeight: 412.93234

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C2=CC=C(C=C2)Cl)C(=O)OCC3=CSC(=N3)NC4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)(C2=CC=C(C=C2)Cl)C(=O)OCC3=CSC(=N3)NC4=CC=CC=C4

InChI

InChI=1S/C22H21ClN2O2S/c23-17-10-8-16(9-11-17)22(12-4-5-13-22)20(26)27-14-19-15-28-21(25-19)24-18-6-2-1-3-7-18/h1-3,6-11,15H,4-5,12-14H2,(H,24,25)