N-[4-[(2-methyl-2-methylsulfonyl-propanoyl)amino]-6-oxidanylidene-cyclohexa-1,4-dien-1-yl]pyridine-4-carboxamide

Systemtic Name: N-[4-[(2-methyl-2-methylsulfonyl-propanoyl)amino]-6-oxidanylidene-cyclohexa-1,4-dien-1-yl]pyridine-4-carboxamide Openeye Name: N-[4-[(2-methyl-2-methylsulfonyl-propanoyl)amino]-6-oxo-cyclohexa-1,4-dien-1-yl]pyridine-4-carboxamide CAS Name: N-[4-[(2-methyl-2-methylsulfonyl-1-oxopropyl)amino]-6-oxo-1-cyclohexa-1,4-dienyl]-4-pyridinecarboxamide IUPAC Name: N-[4-[(2-methyl-2-methylsulfonylpropanoyl)amino]-6-oxocyclohexa-1,4-dien-1-yl]pyridine-4-carboxamide Traditional Name: N-[6-keto-4-[(2-mesyl-2-methyl-propanoyl)amino]cyclohexa-1,4-dien-1-yl]isonicotinamide Formula: C17H19N3O5S MolecularWeight: 377.41486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=CC(=O)C(=CC1)NC(=O)C2=CC=NC=C2)S(=O)(=O)C

Isomeric SMILES

CC(C)(C(=O)NC1=CC(=O)C(=CC1)NC(=O)C2=CC=NC=C2)S(=O)(=O)C

InChI

InChI=1S/C17H19N3O5S/c1-17(2,26(3,24)25)16(23)19-12-4-5-13(14(21)10-12)20-15(22)11-6-8-18-9-7-11/h5-10H,4H2,1-3H3,(H,19,23)(H,20,22)