[4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]carbamoyl]-2-methoxy-phenyl] butanoate

Systemtic Name: [4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]carbamoyl]-2-methoxy-phenyl] butanoate Openeye Name: [4-[[4-(4-chlorophenyl)thiazol-2-yl]carbamoyl]-2-methoxy-phenyl] butanoate CAS Name: butanoic acid [4-[[[4-(4-chlorophenyl)-2-thiazolyl]amino]-oxomethyl]-2-methoxyphenyl] ester IUPAC Name: [4-[[4-(4-chlorophenyl)-1,3-thiazol-2-yl]carbamoyl]-2-methoxyphenyl] butanoate Traditional Name: butyric acid [4-[[4-(4-chlorophenyl)thiazol-2-yl]carbamoyl]-2-methoxy-phenyl] ester Formula: C21H19ClN2O4S MolecularWeight: 430.90456

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=C(C=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Cl)OC

Isomeric SMILES

CCCC(=O)OC1=C(C=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C21H19ClN2O4S/c1-3-4-19(25)28-17-10-7-14(11-18(17)27-2)20(26)24-21-23-16(12-29-21)13-5-8-15(22)9-6-13/h5-12H,3-4H2,1-2H3,(H,23,24,26)