4-chloranyl-N-[4-(2-cyanopyrrol-1-yl)-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-butan-2-yl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[4-(2-cyanopyrrol-1-yl)-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-butan-2-yl]benzenesulfonamide Openeye Name: 4-chloro-N-[3-(2-cyanopyrrol-1-yl)-1-(4-methylpiperidine-1-carbonyl)propyl]benzenesulfonamide CAS Name: 4-chloro-N-[4-(2-cyano-1-pyrrolyl)-1-(4-methyl-1-piperidinyl)-1-oxobutan-2-yl]benzenesulfonamide IUPAC Name: 4-chloro-N-[4-(2-cyanopyrrol-1-yl)-1-(4-methylpiperidin-1-yl)-1-oxobutan-2-yl]benzenesulfonamide Traditional Name: 4-chloro-N-[3-(2-cyanopyrrol-1-yl)-1-(4-methylpiperidine-1-carbonyl)propyl]benzenesulfonamide Formula: C21H25ClN4O3S MolecularWeight: 448.9662

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(CCN2C=CC=C2C#N)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1CCN(CC1)C(=O)C(CCN2C=CC=C2C#N)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H25ClN4O3S/c1-16-8-12-26(13-9-16)21(27)20(10-14-25-11-2-3-18(25)15-23)24-30(28,29)19-6-4-17(22)5-7-19/h2-7,11,16,20,24H,8-10,12-14H2,1H3