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

Systemtic Name: N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-N-methyl-3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanamide Openeye Name: N-[[5-(4-chlorophenyl)-2-furyl]methyl]-N-methyl-3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)propanamide CAS Name: N-[[5-(4-chlorophenyl)-2-furanyl]methyl]-N-methyl-3-[6-methyl-2-(methylthio)-4-oxo-1H-pyrimidin-5-yl]propanamide IUPAC Name: N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-N-methyl-3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)propanamide Traditional Name: N-[[5-(4-chlorophenyl)-2-furyl]methyl]-3-[4-keto-6-methyl-2-(methylthio)-1H-pyrimidin-5-yl]-N-methyl-propionamide Formula: C21H22ClN3O3S MolecularWeight: 431.93568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC)CCC(=O)N(C)CC2=CC=C(O2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SC)CCC(=O)N(C)CC2=CC=C(O2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H22ClN3O3S/c1-13-17(20(27)24-21(23-13)29-3)9-11-19(26)25(2)12-16-8-10-18(28-16)14-4-6-15(22)7-5-14/h4-8,10H,9,11-12H2,1-3H3,(H,23,24,27)