3-(4-methoxyphenyl)propyl 4-(fluoranylmethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: 3-(4-methoxyphenyl)propyl 4-(fluoranylmethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 3-(4-methoxyphenyl)propyl 4-(fluoromethyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(fluoromethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 3-(4-methoxyphenyl)propyl ester IUPAC Name: 3-(4-methoxyphenyl)propyl 4-(fluoromethyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(fluoromethyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 3-(4-methoxyphenyl)propyl ester Formula: C17H21FN2O3S MolecularWeight: 352.423643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)CF)C(=O)OCCCC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=C(C(NC(=S)N1)CF)C(=O)OCCCC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H21FN2O3S/c1-11-15(14(10-18)20-17(24)19-11)16(21)23-9-3-4-12-5-7-13(22-2)8-6-12/h5-8,14H,3-4,9-10H2,1-2H3,(H2,19,20,24)