2-[(2-acetamidopyrimidin-4-yl)methylsulfanyl]-N-(4-chlorophenyl)pyridine-3-carboxamide

Systemtic Name: 2-[(2-acetamidopyrimidin-4-yl)methylsulfanyl]-N-(4-chlorophenyl)pyridine-3-carboxamide Openeye Name: 2-[(2-acetamidopyrimidin-4-yl)methylsulfanyl]-N-(4-chlorophenyl)pyridine-3-carboxamide CAS Name: 2-[(2-acetamido-4-pyrimidinyl)methylthio]-N-(4-chlorophenyl)-3-pyridinecarboxamide IUPAC Name: 2-[(2-acetamidopyrimidin-4-yl)methylsulfanyl]-N-(4-chlorophenyl)pyridine-3-carboxamide Traditional Name: 2-[(2-acetamidopyrimidin-4-yl)methylthio]-N-(4-chlorophenyl)nicotinamide Formula: C19H16ClN5O2S MolecularWeight: 413.88064

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=CC(=N1)CSC2=C(C=CC=N2)C(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)NC1=NC=CC(=N1)CSC2=C(C=CC=N2)C(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H16ClN5O2S/c1-12(26)23-19-22-10-8-15(25-19)11-28-18-16(3-2-9-21-18)17(27)24-14-6-4-13(20)5-7-14/h2-10H,11H2,1H3,(H,24,27)(H,22,23,25,26)