3-[(E)-3-phenylprop-2-enoyl]-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 3-[(E)-3-phenylprop-2-enoyl]-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-[(E)-3-phenylprop-2-enoyl]-2-thioxo-quinazolin-4-olate CAS Name: 3-[(E)-1-oxo-3-phenylprop-2-enyl]-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-[(E)-3-phenylprop-2-enoyl]-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-[(E)-3-phenylacryloyl]-2-thioxo-quinazolin-4-olate Formula: C17H11N2O2S- MolecularWeight: 307.34644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)N2C(=C3C=CC=CC3=NC2=S)[O-]

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)N2C(=C3C=CC=CC3=NC2=S)[O-]

InChI

InChI=1S/C17H12N2O2S/c20-15(11-10-12-6-2-1-3-7-12)19-16(21)13-8-4-5-9-14(13)18-17(19)22/h1-11,21H/p-1/b11-10+