N-[4-(4-ethylpiperazin-1-yl)phenyl]-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)phenyl]-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)phenyl]-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)phenyl]-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)phenyl]-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-[4-(4-ethylpiperazino)phenyl]-2-(phenylthio)nicotinamide Formula: C24H26N4OS MolecularWeight: 418.55444

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(N=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C24H26N4OS/c1-2-27-15-17-28(18-16-27)20-12-10-19(11-13-20)26-23(29)22-9-6-14-25-24(22)30-21-7-4-3-5-8-21/h3-14H,2,15-18H2,1H3,(H,26,29)