2-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-N-[(phenylmethyl)carbamoyl]ethanamide

Systemtic Name: 2-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-N-[(phenylmethyl)carbamoyl]ethanamide Openeye Name: N-(benzylcarbamoyl)-2-[2-methyl-5-(1-piperidylsulfonyl)anilino]acetamide CAS Name: 2-[2-methyl-5-(1-piperidinylsulfonyl)anilino]-N-[oxo-[(phenylmethyl)amino]methyl]acetamide IUPAC Name: N-(benzylcarbamoyl)-2-(2-methyl-5-piperidin-1-ylsulfonylanilino)acetamide Traditional Name: N-(benzylcarbamoyl)-2-(2-methyl-5-piperidinosulfonyl-anilino)acetamide Formula: C22H28N4O4S MolecularWeight: 444.54712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NCC(=O)NC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NCC(=O)NC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H28N4O4S/c1-17-10-11-19(31(29,30)26-12-6-3-7-13-26)14-20(17)23-16-21(27)25-22(28)24-15-18-8-4-2-5-9-18/h2,4-5,8-11,14,23H,3,6-7,12-13,15-16H2,1H3,(H2,24,25,27,28)