4,5,6-trimethyl-2-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]sulfanyl-pyridine-3-carboxamide

Systemtic Name: 4,5,6-trimethyl-2-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]sulfanyl-pyridine-3-carboxamide Openeye Name: 4,5,6-trimethyl-2-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]sulfanyl-pyridine-3-carboxamide CAS Name: 4,5,6-trimethyl-2-[[2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethyl]thio]-3-pyridinecarboxamide IUPAC Name: 4,5,6-trimethyl-2-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]sulfanylpyridine-3-carboxamide Traditional Name: 2-[[2-keto-2-[4-(2-thenoyl)piperazino]ethyl]thio]-4,5,6-trimethyl-nicotinamide Formula: C20H24N4O3S2 MolecularWeight: 432.55956

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C(=O)N)SCC(=O)N2CCN(CC2)C(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C(=O)N)SCC(=O)N2CCN(CC2)C(=O)C3=CC=CS3)C

InChI

InChI=1S/C20H24N4O3S2/c1-12-13(2)17(18(21)26)19(22-14(12)3)29-11-16(25)23-6-8-24(9-7-23)20(27)15-5-4-10-28-15/h4-5,10H,6-9,11H2,1-3H3,(H2,21,26)