(2R)-N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-1-thiophen-2-ylcarbonyl-piperidine-2-carboxamide

Systemtic Name: (2R)-N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-1-thiophen-2-ylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-1-(thiophene-2-carbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-1-[oxo(thiophen-2-yl)methyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-1-(thiophene-2-carbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-1-(2-thenoyl)pipecolinamide Formula: C24H31N3O4S2 MolecularWeight: 489.65064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCCCN2C(=O)C3=CC=CS3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H]2CCCCN2C(=O)C3=CC=CS3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C24H31N3O4S2/c1-18-11-12-19(17-22(18)33(30,31)26-13-5-2-3-6-14-26)25-23(28)20-9-4-7-15-27(20)24(29)21-10-8-16-32-21/h8,10-12,16-17,20H,2-7,9,13-15H2,1H3,(H,25,28)/t20-/m1/s1