N-[1-butyl-4,5-dimethyl-3-(phenylsulfonyl)pyrrol-2-yl]-6-chloranyl-pyridine-3-carboxamide

Systemtic Name: N-[1-butyl-4,5-dimethyl-3-(phenylsulfonyl)pyrrol-2-yl]-6-chloranyl-pyridine-3-carboxamide Openeye Name: N-[3-(benzenesulfonyl)-1-butyl-4,5-dimethyl-pyrrol-2-yl]-6-chloro-pyridine-3-carboxamide CAS Name: N-[3-(benzenesulfonyl)-1-butyl-4,5-dimethyl-2-pyrrolyl]-6-chloro-3-pyridinecarboxamide IUPAC Name: N-[3-(benzenesulfonyl)-1-butyl-4,5-dimethylpyrrol-2-yl]-6-chloropyridine-3-carboxamide Traditional Name: N-(3-besyl-1-butyl-4,5-dimethyl-pyrrol-2-yl)-6-chloro-nicotinamide Formula: C22H24ClN3O3S MolecularWeight: 445.96226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=C1NC(=O)C2=CN=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CCCCN1C(=C(C(=C1NC(=O)C2=CN=C(C=C2)Cl)S(=O)(=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C22H24ClN3O3S/c1-4-5-13-26-16(3)15(2)20(30(28,29)18-9-7-6-8-10-18)21(26)25-22(27)17-11-12-19(23)24-14-17/h6-12,14H,4-5,13H2,1-3H3,(H,25,27)