3-ethyl-7-[(3-ethynylphenyl)carbamoyl]-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 3-ethyl-7-[(3-ethynylphenyl)carbamoyl]-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-ethyl-7-[(3-ethynylphenyl)carbamoyl]-2-thioxo-quinazolin-4-olate CAS Name: 3-ethyl-7-[(3-ethynylanilino)-oxomethyl]-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-ethyl-7-[(3-ethynylphenyl)carbamoyl]-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-ethyl-7-[(3-ethynylphenyl)carbamoyl]-2-thioxo-quinazolin-4-olate Formula: C19H14N3O2S- MolecularWeight: 348.39836

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C2C=CC(=CC2=NC1=S)C(=O)NC3=CC=CC(=C3)C#C)[O-]

Isomeric SMILES

CCN1C(=C2C=CC(=CC2=NC1=S)C(=O)NC3=CC=CC(=C3)C#C)[O-]

InChI

InChI=1S/C19H15N3O2S/c1-3-12-6-5-7-14(10-12)20-17(23)13-8-9-15-16(11-13)21-19(25)22(4-2)18(15)24/h1,5-11,24H,4H2,2H3,(H,20,23)/p-1