N-[4-(3-fluoranyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[4-(3-fluoranyl-4-methoxy-phenyl)-1,3-thiazol-2-yl]-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[4-(3-fluoro-4-methoxy-phenyl)thiazol-2-yl]-1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carboxamide CAS Name: N-[4-(3-fluoro-4-methoxyphenyl)-2-thiazolyl]-1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-2-yl]-1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[4-(3-fluoro-4-methoxy-phenyl)thiazol-2-yl]-1-[(5-methyl-2-thienyl)sulfonyl]nipecotamide Formula: C21H22FN3O4S3 MolecularWeight: 495.610483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=NC(=CS3)C4=CC(=C(C=C4)OC)F

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=NC(=CS3)C4=CC(=C(C=C4)OC)F

InChI

InChI=1S/C21H22FN3O4S3/c1-13-5-8-19(31-13)32(27,28)25-9-3-4-15(11-25)20(26)24-21-23-17(12-30-21)14-6-7-18(29-2)16(22)10-14/h5-8,10,12,15H,3-4,9,11H2,1-2H3,(H,23,24,26)