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

Systemtic Name: N-(4-chlorophenyl)-2-[(2-morpholin-4-ylpyrimidin-4-yl)methylsulfanyl]pyridine-3-carboxamide Openeye Name: N-(4-chlorophenyl)-2-[(2-morpholinopyrimidin-4-yl)methylsulfanyl]pyridine-3-carboxamide CAS Name: N-(4-chlorophenyl)-2-[[2-(4-morpholinyl)-4-pyrimidinyl]methylthio]-3-pyridinecarboxamide IUPAC Name: N-(4-chlorophenyl)-2-[(2-morpholin-4-ylpyrimidin-4-yl)methylsulfanyl]pyridine-3-carboxamide Traditional Name: N-(4-chlorophenyl)-2-[(2-morpholinopyrimidin-4-yl)methylthio]nicotinamide Formula: C21H20ClN5O2S MolecularWeight: 441.9338

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC=CC(=N2)CSC3=C(C=CC=N3)C(=O)NC4=CC=C(C=C4)Cl

Isomeric SMILES

C1COCCN1C2=NC=CC(=N2)CSC3=C(C=CC=N3)C(=O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H20ClN5O2S/c22-15-3-5-16(6-4-15)25-19(28)18-2-1-8-23-20(18)30-14-17-7-9-24-21(26-17)27-10-12-29-13-11-27/h1-9H,10-14H2,(H,25,28)