N-(2-ethylsulfanylethyl)-6-[4-(2-phenylcyclopropyl)carbonylpiperazin-1-yl]pyridine-3-carboxamide

Systemtic Name: N-(2-ethylsulfanylethyl)-6-[4-(2-phenylcyclopropyl)carbonylpiperazin-1-yl]pyridine-3-carboxamide Openeye Name: N-(2-ethylsulfanylethyl)-6-[4-(2-phenylcyclopropanecarbonyl)piperazin-1-yl]pyridine-3-carboxamide CAS Name: N-[2-(ethylthio)ethyl]-6-[4-[oxo-(2-phenylcyclopropyl)methyl]-1-piperazinyl]-3-pyridinecarboxamide IUPAC Name: N-(2-ethylsulfanylethyl)-6-[4-(2-phenylcyclopropanecarbonyl)piperazin-1-yl]pyridine-3-carboxamide Traditional Name: N-[2-(ethylthio)ethyl]-6-[4-(2-phenylcyclopropanecarbonyl)piperazino]nicotinamide Formula: C24H30N4O2S MolecularWeight: 438.5856

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCNC(=O)C1=CN=C(C=C1)N2CCN(CC2)C(=O)C3CC3C4=CC=CC=C4

Isomeric SMILES

CCSCCNC(=O)C1=CN=C(C=C1)N2CCN(CC2)C(=O)C3CC3C4=CC=CC=C4

InChI

InChI=1S/C24H30N4O2S/c1-2-31-15-10-25-23(29)19-8-9-22(26-17-19)27-11-13-28(14-12-27)24(30)21-16-20(21)18-6-4-3-5-7-18/h3-9,17,20-21H,2,10-16H2,1H3,(H,25,29)