2-chloranyl-N-[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: 2-chloro-N-[2-(3,4-diethoxyanilino)-2-oxo-ethyl]-N-methyl-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-[2-(3,4-diethoxyanilino)-2-oxoethyl]-N-methyl-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: 2-chloro-N-[2-(3,4-diethoxyanilino)-2-oxoethyl]-N-methyl-5-piperidin-1-ylsulfonylbenzamide Traditional Name: 2-chloro-N-[2-(3,4-diethoxyanilino)-2-keto-ethyl]-N-methyl-5-piperidinosulfonyl-benzamide Formula: C25H32ClN3O6S MolecularWeight: 538.05608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CN(C)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CN(C)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)Cl)OCC

InChI

InChI=1S/C25H32ClN3O6S/c1-4-34-22-12-9-18(15-23(22)35-5-2)27-24(30)17-28(3)25(31)20-16-19(10-11-21(20)26)36(32,33)29-13-7-6-8-14-29/h9-12,15-16H,4-8,13-14,17H2,1-3H3,(H,27,30)