N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(2,6-dimethylanilino)-2-oxo-ethyl]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[2-(2,6-dimethylanilino)-2-oxoethyl]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[2-(2,6-dimethylanilino)-2-oxoethyl]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(2,6-dimethylanilino)-2-keto-ethyl]-4-piperidinosulfonyl-benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CNC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H27N3O4S/c1-16-7-6-8-17(2)21(16)24-20(26)15-23-22(27)18-9-11-19(12-10-18)30(28,29)25-13-4-3-5-14-25/h6-12H,3-5,13-15H2,1-2H3,(H,23,27)(H,24,26)