(3E)-7-methyl-3-(6-phenyl-2-sulfanylidene-1H-pyrimidin-4-ylidene)chromene-2,4-dione

Systemtic Name: (3E)-7-methyl-3-(6-phenyl-2-sulfanylidene-1H-pyrimidin-4-ylidene)chromene-2,4-dione Openeye Name: (3E)-7-methyl-3-(6-phenyl-2-thioxo-1H-pyrimidin-4-ylidene)chromane-2,4-dione CAS Name: (3E)-7-methyl-3-(6-phenyl-2-sulfanylidene-1H-pyrimidin-4-ylidene)-3,4-dihydro-2H-1-benzopyran-2,4-dione IUPAC Name: (3E)-7-methyl-3-(6-phenyl-2-sulfanylidene-1H-pyrimidin-4-ylidene)chromene-2,4-dione Traditional Name: (3E)-7-methyl-3-(6-phenyl-2-thioxo-1H-pyrimidin-4-ylidene)chroman-2,4-quinone Formula: C20H14N2O3S MolecularWeight: 362.40176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)C(=C3C=C(NC(=S)N3)C4=CC=CC=C4)C(=O)O2

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)/C(=C\3/C=C(NC(=S)N3)C4=CC=CC=C4)/C(=O)O2

InChI

InChI=1S/C20H14N2O3S/c1-11-7-8-13-16(9-11)25-19(24)17(18(13)23)15-10-14(21-20(26)22-15)12-5-3-2-4-6-12/h2-10H,1H3,(H2,21,22,26)/b17-15+