N-[4-[1,1-bis(oxidanylidene)thian-4-yl]-2-(4-methylpiperidin-1-yl)phenyl]-4-cyano-1H-pyrrole-2-carboxamide

Systemtic Name: N-[4-[1,1-bis(oxidanylidene)thian-4-yl]-2-(4-methylpiperidin-1-yl)phenyl]-4-cyano-1H-pyrrole-2-carboxamide Openeye Name: 4-cyano-N-[4-(1,1-dioxothian-4-yl)-2-(4-methyl-1-piperidyl)phenyl]-1H-pyrrole-2-carboxamide CAS Name: 4-cyano-N-[4-(1,1-dioxo-4-thianyl)-2-(4-methyl-1-piperidinyl)phenyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-cyano-N-[4-(1,1-dioxothian-4-yl)-2-(4-methylpiperidin-1-yl)phenyl]-1H-pyrrole-2-carboxamide Traditional Name: 4-cyano-N-[4-(1,1-diketothian-4-yl)-2-(4-methylpiperidino)phenyl]-1H-pyrrole-2-carboxamide Formula: C23H28N4O3S MolecularWeight: 440.55842

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=CC(=C2)C3CCS(=O)(=O)CC3)NC(=O)C4=CC(=CN4)C#N

Isomeric SMILES

CC1CCN(CC1)C2=C(C=CC(=C2)C3CCS(=O)(=O)CC3)NC(=O)C4=CC(=CN4)C#N

InChI

InChI=1S/C23H28N4O3S/c1-16-4-8-27(9-5-16)22-13-19(18-6-10-31(29,30)11-7-18)2-3-20(22)26-23(28)21-12-17(14-24)15-25-21/h2-3,12-13,15-16,18,25H,4-11H2,1H3,(H,26,28)