N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-[3-[4-(4-methoxyphenyl)-1-piperazinyl]propyl]-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-[3-[4-(4-methoxyphenyl)piperazino]propyl]-2-(phenylthio)nicotinamide Formula: C26H30N4O2S MolecularWeight: 462.607

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CCCNC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CCCNC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C26H30N4O2S/c1-32-22-12-10-21(11-13-22)30-19-17-29(18-20-30)16-6-15-27-25(31)24-9-5-14-28-26(24)33-23-7-3-2-4-8-23/h2-5,7-14H,6,15-20H2,1H3,(H,27,31)