S-quinazolin-4-yl 4-methoxybenzenecarbothioate

Systemtic Name: S-quinazolin-4-yl 4-methoxybenzenecarbothioate Openeye Name: S-quinazolin-4-yl 4-methoxybenzenecarbothioate CAS Name: 4-methoxybenzenecarbothioic acid S-(4-quinazolinyl) ester IUPAC Name: S-quinazolin-4-yl 4-methoxybenzenecarbothioate Traditional Name: 4-methoxythiobenzoic acid S-quinazolin-4-yl ester Formula: C16H12N2O2S MolecularWeight: 296.34368

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)SC2=NC=NC3=CC=CC=C32

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)SC2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C16H12N2O2S/c1-20-12-8-6-11(7-9-12)16(19)21-15-13-4-2-3-5-14(13)17-10-18-15/h2-10H,1H3