3,4-dimethyl-N-[2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]benzamide

Systemtic Name: 3,4-dimethyl-N-[2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl]benzamide Openeye Name: 3,4-dimethyl-N-[2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl]benzamide CAS Name: 3,4-dimethyl-N-[2-oxo-2-[3-(1-pyrrolidinylsulfonyl)anilino]ethyl]benzamide IUPAC Name: 3,4-dimethyl-N-[2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl]benzamide Traditional Name: N-[2-keto-2-(3-pyrrolidinosulfonylanilino)ethyl]-3,4-dimethyl-benzamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3)C

InChI

InChI=1S/C21H25N3O4S/c1-15-8-9-17(12-16(15)2)21(26)22-14-20(25)23-18-6-5-7-19(13-18)29(27,28)24-10-3-4-11-24/h5-9,12-13H,3-4,10-11,14H2,1-2H3,(H,22,26)(H,23,25)