N-[4-(3-chloranyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: N-[4-(3-chloranyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-[4-(3-chloro-4-methoxy-phenyl)thiazol-2-yl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide CAS Name: N-[4-(3-chloro-4-methoxyphenyl)-2-thiazolyl]-1-[oxo(thiophen-2-yl)methyl]-3-piperidinecarboxamide IUPAC Name: N-[4-(3-chloro-4-methoxyphenyl)-1,3-thiazol-2-yl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-[4-(3-chloro-4-methoxy-phenyl)thiazol-2-yl]-1-(2-thenoyl)nipecotamide Formula: C21H20ClN3O3S2 MolecularWeight: 461.9848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3CCCN(C3)C(=O)C4=CC=CS4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)C3CCCN(C3)C(=O)C4=CC=CS4)Cl

InChI

InChI=1S/C21H20ClN3O3S2/c1-28-17-7-6-13(10-15(17)22)16-12-30-21(23-16)24-19(26)14-4-2-8-25(11-14)20(27)18-5-3-9-29-18/h3,5-7,9-10,12,14H,2,4,8,11H2,1H3,(H,23,24,26)