N-[4-(cyanomethyl)phenyl]-N-propan-2-ylsulfonyl-6-pyrrol-1-yl-pyridine-3-carboxamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-N-propan-2-ylsulfonyl-6-pyrrol-1-yl-pyridine-3-carboxamide Openeye Name: N-[4-(cyanomethyl)phenyl]-N-isopropylsulfonyl-6-pyrrol-1-yl-pyridine-3-carboxamide CAS Name: N-[4-(cyanomethyl)phenyl]-N-propan-2-ylsulfonyl-6-(1-pyrrolyl)-3-pyridinecarboxamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-N-propan-2-ylsulfonyl-6-pyrrol-1-ylpyridine-3-carboxamide Traditional Name: N-[4-(cyanomethyl)phenyl]-N-isopropylsulfonyl-6-pyrrol-1-yl-nicotinamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N(C1=CC=C(C=C1)CC#N)C(=O)C2=CN=C(C=C2)N3C=CC=C3

Isomeric SMILES

CC(C)S(=O)(=O)N(C1=CC=C(C=C1)CC#N)C(=O)C2=CN=C(C=C2)N3C=CC=C3

InChI

InChI=1S/C21H20N4O3S/c1-16(2)29(27,28)25(19-8-5-17(6-9-19)11-12-22)21(26)18-7-10-20(23-15-18)24-13-3-4-14-24/h3-10,13-16H,11H2,1-2H3