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

Systemtic Name: [5-(4-nitrophenyl)furan-2-yl]methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: [5-(4-nitrophenyl)-2-furyl]methyl 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid [5-(4-nitrophenyl)-2-furanyl]methyl ester IUPAC Name: [5-(4-nitrophenyl)furan-2-yl]methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid [5-(4-nitrophenyl)-2-furyl]methyl ester Formula: C17H15N3O5S MolecularWeight: 373.3831

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CNC(=S)N1)C(=O)OCC2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(CNC(=S)N1)C(=O)OCC2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O5S/c1-10-14(8-18-17(26)19-10)16(21)24-9-13-6-7-15(25-13)11-2-4-12(5-3-11)20(22)23/h2-7H,8-9H2,1H3,(H2,18,19,26)