(3S)-1-(4-methoxyphenyl)sulfonyl-N-(4-phenyl-1,3-thiazol-2-yl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-methoxyphenyl)sulfonyl-N-(4-phenyl-1,3-thiazol-2-yl)piperidine-3-carboxamide Openeye Name: (3S)-1-(4-methoxyphenyl)sulfonyl-N-(4-phenylthiazol-2-yl)piperidine-3-carboxamide CAS Name: (3S)-1-(4-methoxyphenyl)sulfonyl-N-(4-phenyl-2-thiazolyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-methoxyphenyl)sulfonyl-N-(4-phenyl-1,3-thiazol-2-yl)piperidine-3-carboxamide Traditional Name: (3S)-1-(4-methoxyphenyl)sulfonyl-N-(4-phenylthiazol-2-yl)nipecotamide Formula: C22H23N3O4S2 MolecularWeight: 457.56572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@@H](C2)C(=O)NC3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N3O4S2/c1-29-18-9-11-19(12-10-18)31(27,28)25-13-5-8-17(14-25)21(26)24-22-23-20(15-30-22)16-6-3-2-4-7-16/h2-4,6-7,9-12,15,17H,5,8,13-14H2,1H3,(H,23,24,26)/t17-/m0/s1