methyl 5-(1,3-benzothiazol-2-yl)-6-phenyl-2-sulfanylidene-5,6-dihydro-1H-pyrimidine-4-carboxylate

Systemtic Name: methyl 5-(1,3-benzothiazol-2-yl)-6-phenyl-2-sulfanylidene-5,6-dihydro-1H-pyrimidine-4-carboxylate Openeye Name: methyl 5-(1,3-benzothiazol-2-yl)-6-phenyl-2-thioxo-5,6-dihydro-1H-pyrimidine-4-carboxylate CAS Name: 5-(1,3-benzothiazol-2-yl)-6-phenyl-2-sulfanylidene-5,6-dihydro-1H-pyrimidine-4-carboxylic acid methyl ester IUPAC Name: methyl 5-(1,3-benzothiazol-2-yl)-6-phenyl-2-sulfanylidene-5,6-dihydro-1H-pyrimidine-4-carboxylate Traditional Name: 5-(1,3-benzothiazol-2-yl)-6-phenyl-2-thioxo-5,6-dihydro-1H-pyrimidine-4-carboxylic acid methyl ester Formula: C19H15N3O2S2 MolecularWeight: 381.4713

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC(=S)NC(C1C2=NC3=CC=CC=C3S2)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=NC(=S)NC(C1C2=NC3=CC=CC=C3S2)C4=CC=CC=C4

InChI

InChI=1S/C19H15N3O2S2/c1-24-18(23)16-14(17-20-12-9-5-6-10-13(12)26-17)15(21-19(25)22-16)11-7-3-2-4-8-11/h2-10,14-15H,1H3,(H,21,25)