N-[4-(azepan-1-ylmethyl)-1,3-thiazol-2-yl]-1-(4-methylphenyl)sulfonyl-piperidine-2-carboxamide

Systemtic Name: N-[4-(azepan-1-ylmethyl)-1,3-thiazol-2-yl]-1-(4-methylphenyl)sulfonyl-piperidine-2-carboxamide Openeye Name: N-[4-(azepan-1-ylmethyl)thiazol-2-yl]-1-(p-tolylsulfonyl)piperidine-2-carboxamide CAS Name: N-[4-(1-azepanylmethyl)-2-thiazolyl]-1-(4-methylphenyl)sulfonyl-2-piperidinecarboxamide IUPAC Name: N-[4-(azepan-1-ylmethyl)-1,3-thiazol-2-yl]-1-(4-methylphenyl)sulfonylpiperidine-2-carboxamide Traditional Name: N-[4-(azepan-1-ylmethyl)thiazol-2-yl]-1-tosyl-pipecolinamide Formula: C23H32N4O3S2 MolecularWeight: 476.65518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)NC3=NC(=CS3)CN4CCCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)NC3=NC(=CS3)CN4CCCCCC4

InChI

InChI=1S/C23H32N4O3S2/c1-18-9-11-20(12-10-18)32(29,30)27-15-7-4-8-21(27)22(28)25-23-24-19(17-31-23)16-26-13-5-2-3-6-14-26/h9-12,17,21H,2-8,13-16H2,1H3,(H,24,25,28)