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

Systemtic Name: N-[(4-fluorophenyl)-thiophen-2-yl-methyl]-3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanamide Openeye Name: N-[(4-fluorophenyl)-(2-thienyl)methyl]-3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)propanamide CAS Name: N-[(4-fluorophenyl)-thiophen-2-ylmethyl]-3-[6-methyl-2-(methylthio)-4-oxo-1H-pyrimidin-5-yl]propanamide IUPAC Name: N-[(4-fluorophenyl)-thiophen-2-ylmethyl]-3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)propanamide Traditional Name: N-[(4-fluorophenyl)-(2-thienyl)methyl]-3-[4-keto-6-methyl-2-(methylthio)-1H-pyrimidin-5-yl]propionamide Formula: C20H20FN3O2S2 MolecularWeight: 417.520103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC)CCC(=O)NC(C2=CC=C(C=C2)F)C3=CC=CS3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SC)CCC(=O)NC(C2=CC=C(C=C2)F)C3=CC=CS3

InChI

InChI=1S/C20H20FN3O2S2/c1-12-15(19(26)24-20(22-12)27-2)9-10-17(25)23-18(16-4-3-11-28-16)13-5-7-14(21)8-6-13/h3-8,11,18H,9-10H2,1-2H3,(H,23,25)(H,22,24,26)