2-[(3-fluorophenyl)methylsulfanyl]-4-(2-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide

Systemtic Name: 2-[(3-fluorophenyl)methylsulfanyl]-4-(2-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide Openeye Name: 2-[(3-fluorophenyl)methylsulfanyl]-4-(2-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide CAS Name: 2-[(3-fluorophenyl)methylthio]-4-(2-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide IUPAC Name: 2-[(3-fluorophenyl)methylsulfanyl]-4-(2-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide Traditional Name: 2-[(3-fluorobenzyl)thio]-4-(2-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-5-carboxamide Formula: C20H20FN3O2S MolecularWeight: 385.455103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N=C(N1)SCC2=CC(=CC=C2)F)C3=CC=CC=C3OC)C(=O)N

Isomeric SMILES

CC1=C(C(N=C(N1)SCC2=CC(=CC=C2)F)C3=CC=CC=C3OC)C(=O)N

InChI

InChI=1S/C20H20FN3O2S/c1-12-17(19(22)25)18(15-8-3-4-9-16(15)26-2)24-20(23-12)27-11-13-6-5-7-14(21)10-13/h3-10,18H,11H2,1-2H3,(H2,22,25)(H,23,24)