N-[4-(4-ethylpiperazin-1-yl)phenyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)phenyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)phenyl]-2-[(5-methylisoxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)phenyl]-2-[(5-methyl-3-isoxazolyl)methylthio]-3-pyridinecarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)phenyl]-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfanyl]pyridine-3-carboxamide Traditional Name: N-[4-(4-ethylpiperazino)phenyl]-2-[(5-methylisoxazol-3-yl)methylthio]nicotinamide Formula: C23H27N5O2S MolecularWeight: 437.55778

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(N=CC=C3)SCC4=NOC(=C4)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=C(N=CC=C3)SCC4=NOC(=C4)C

InChI

InChI=1S/C23H27N5O2S/c1-3-27-11-13-28(14-12-27)20-8-6-18(7-9-20)25-22(29)21-5-4-10-24-23(21)31-16-19-15-17(2)30-26-19/h4-10,15H,3,11-14,16H2,1-2H3,(H,25,29)