N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(2-ethylanilino)-2-oxo-ethyl]-N-methyl-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(2-ethylanilino)-2-keto-ethyl]-N-methyl-3-pyrrolidinosulfonyl-benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CN(C)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CN(C)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C22H27N3O4S/c1-3-17-9-4-5-12-20(17)23-21(26)16-24(2)22(27)18-10-8-11-19(15-18)30(28,29)25-13-6-7-14-25/h4-5,8-12,15H,3,6-7,13-14,16H2,1-2H3,(H,23,26)