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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H24ClN3O4S/c1-15-5-8-17(9-6-15)23-20(26)14-24(2)21(27)16-7-10-18(22)19(13-16)30(28,29)25-11-3-4-12-25/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,23,26)