N,N-diethyl-6-methyl-2-sulfanylidene-4-[4-(trifluoromethyloxy)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: N,N-diethyl-6-methyl-2-sulfanylidene-4-[4-(trifluoromethyloxy)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: N,N-diethyl-6-methyl-2-thioxo-4-[4-(trifluoromethoxy)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: N,N-diethyl-6-methyl-2-sulfanylidene-4-[4-(trifluoromethoxy)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: N,N-diethyl-6-methyl-2-sulfanylidene-4-[4-(trifluoromethoxy)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: N,N-diethyl-6-methyl-2-thioxo-4-[4-(trifluoromethoxy)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C17H20F3N3O2S MolecularWeight: 387.41981

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(NC(=S)NC1C2=CC=C(C=C2)OC(F)(F)F)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(NC(=S)NC1C2=CC=C(C=C2)OC(F)(F)F)C

InChI

InChI=1S/C17H20F3N3O2S/c1-4-23(5-2)15(24)13-10(3)21-16(26)22-14(13)11-6-8-12(9-7-11)25-17(18,19)20/h6-9,14H,4-5H2,1-3H3,(H2,21,22,26)