2-ethoxy-6-phenyl-4-sulfanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 2-ethoxy-6-phenyl-4-sulfanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 2-ethoxy-6-phenyl-4-thioxo-1H-pyrimidine-5-carbonitrile CAS Name: 2-ethoxy-6-phenyl-4-sulfanylidene-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-ethoxy-6-phenyl-4-sulfanylidene-1H-pyrimidine-5-carbonitrile Traditional Name: 2-ethoxy-6-phenyl-4-thioxo-1H-pyrimidine-5-carbonitrile Formula: C13H11N3OS MolecularWeight: 257.31094

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=S)C(=C(N1)C2=CC=CC=C2)C#N

Isomeric SMILES

CCOC1=NC(=S)C(=C(N1)C2=CC=CC=C2)C#N

InChI

InChI=1S/C13H11N3OS/c1-2-17-13-15-11(9-6-4-3-5-7-9)10(8-14)12(18)16-13/h3-7H,2H2,1H3,(H,15,16,18)