N-[5-[(2-chloranyl-3-methyl-phenyl)methyl]-1,3-thiazol-2-yl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[5-[(2-chloranyl-3-methyl-phenyl)methyl]-1,3-thiazol-2-yl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[5-[(2-chloro-3-methyl-phenyl)methyl]thiazol-2-yl]-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[5-[(2-chloro-3-methylphenyl)methyl]-2-thiazolyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[5-[(2-chloro-3-methylphenyl)methyl]-1,3-thiazol-2-yl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[5-(2-chloro-3-methyl-benzyl)thiazol-2-yl]-1-(3-pyridylsulfonyl)isonipecotamide Formula: C22H23ClN4O3S2 MolecularWeight: 491.02602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)CC2=CN=C(S2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)CC2=CN=C(S2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CN=CC=C4)Cl

InChI

InChI=1S/C22H23ClN4O3S2/c1-15-4-2-5-17(20(15)23)12-18-13-25-22(31-18)26-21(28)16-7-10-27(11-8-16)32(29,30)19-6-3-9-24-14-19/h2-6,9,13-14,16H,7-8,10-12H2,1H3,(H,25,26,28)