methyl (4R)-6-methyl-4-[5-(2-methyl-4-nitro-phenyl)furan-2-yl]-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4R)-6-methyl-4-[5-(2-methyl-4-nitro-phenyl)furan-2-yl]-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: methyl (4R)-6-methyl-4-[5-(2-methyl-4-nitro-phenyl)-2-furyl]-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-6-methyl-4-[5-(2-methyl-4-nitrophenyl)-2-furanyl]-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4R)-6-methyl-4-[5-(2-methyl-4-nitrophenyl)furan-2-yl]-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-6-methyl-4-[5-(2-methyl-4-nitro-phenyl)-2-furyl]-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid methyl ester Formula: C18H17N3O5S MolecularWeight: 387.40968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)C3C(=C(NC(=S)N3)C)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)[C@H]3C(=C(NC(=S)N3)C)C(=O)OC

InChI

InChI=1S/C18H17N3O5S/c1-9-8-11(21(23)24)4-5-12(9)13-6-7-14(26-13)16-15(17(22)25-3)10(2)19-18(27)20-16/h4-8,16H,1-3H3,(H2,19,20,27)/t16-/m0/s1