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

Systemtic Name: 4-chloranyl-N-[2-[(2-ethylphenyl)amino]-2-oxidanylidene-ethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-[2-(2-ethylanilino)-2-oxo-ethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-chloro-N-[2-(2-ethylanilino)-2-oxoethyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-[2-(2-ethylanilino)-2-oxoethyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-[2-(2-ethylanilino)-2-keto-ethyl]-3-pyrrolidinosulfonyl-benzamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CNC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CNC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H24ClN3O4S/c1-2-15-7-3-4-8-18(15)24-20(26)14-23-21(27)16-9-10-17(22)19(13-16)30(28,29)25-11-5-6-12-25/h3-4,7-10,13H,2,5-6,11-12,14H2,1H3,(H,23,27)(H,24,26)