3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]propanamide

Systemtic Name: 3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]propanamide Openeye Name: 3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-N-[(2-pyrazol-1-yl-4-pyridyl)methyl]propanamide CAS Name: 3-[6-methyl-2-(methylthio)-4-oxo-1H-pyrimidin-5-yl]-N-[[2-(1-pyrazolyl)-4-pyridinyl]methyl]propanamide IUPAC Name: 3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]propanamide Traditional Name: 3-[4-keto-6-methyl-2-(methylthio)-1H-pyrimidin-5-yl]-N-[(2-pyrazol-1-yl-4-pyridyl)methyl]propionamide Formula: C18H20N6O2S MolecularWeight: 384.4554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC)CCC(=O)NCC2=CC(=NC=C2)N3C=CC=N3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SC)CCC(=O)NCC2=CC(=NC=C2)N3C=CC=N3

InChI

InChI=1S/C18H20N6O2S/c1-12-14(17(26)23-18(22-12)27-2)4-5-16(25)20-11-13-6-8-19-15(10-13)24-9-3-7-21-24/h3,6-10H,4-5,11H2,1-2H3,(H,20,25)(H,22,23,26)