N-(4-chlorophenyl)-2-[[2-(2-piperazin-1-ylethanoylamino)pyridin-4-yl]methylsulfanyl]pyridine-3-carboxamide

Systemtic Name: N-(4-chlorophenyl)-2-[[2-(2-piperazin-1-ylethanoylamino)pyridin-4-yl]methylsulfanyl]pyridine-3-carboxamide Openeye Name: N-(4-chlorophenyl)-2-[[2-[(2-piperazin-1-ylacetyl)amino]-4-pyridyl]methylsulfanyl]pyridine-3-carboxamide CAS Name: N-(4-chlorophenyl)-2-[[2-[[1-oxo-2-(1-piperazinyl)ethyl]amino]-4-pyridinyl]methylthio]-3-pyridinecarboxamide IUPAC Name: N-(4-chlorophenyl)-2-[[2-[(2-piperazin-1-ylacetyl)amino]pyridin-4-yl]methylsulfanyl]pyridine-3-carboxamide Traditional Name: N-(4-chlorophenyl)-2-[[2-[(2-piperazinoacetyl)amino]-4-pyridyl]methylthio]nicotinamide Formula: C24H25ClN6O2S MolecularWeight: 497.0123

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC(=O)NC2=NC=CC(=C2)CSC3=C(C=CC=N3)C(=O)NC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1)CC(=O)NC2=NC=CC(=C2)CSC3=C(C=CC=N3)C(=O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H25ClN6O2S/c25-18-3-5-19(6-4-18)29-23(33)20-2-1-8-28-24(20)34-16-17-7-9-27-21(14-17)30-22(32)15-31-12-10-26-11-13-31/h1-9,14,26H,10-13,15-16H2,(H,29,33)(H,27,30,32)