S-quinazolin-4-yl 3,4,5-trimethoxybenzenecarbothioate

Systemtic Name: S-quinazolin-4-yl 3,4,5-trimethoxybenzenecarbothioate Openeye Name: S-quinazolin-4-yl 3,4,5-trimethoxybenzenecarbothioate CAS Name: 3,4,5-trimethoxybenzenecarbothioic acid S-(4-quinazolinyl) ester IUPAC Name: S-quinazolin-4-yl 3,4,5-trimethoxybenzenecarbothioate Traditional Name: 3,4,5-trimethoxythiobenzoic acid S-quinazolin-4-yl ester Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)SC2=NC=NC3=CC=CC=C32

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)SC2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C18H16N2O4S/c1-22-14-8-11(9-15(23-2)16(14)24-3)18(21)25-17-12-6-4-5-7-13(12)19-10-20-17/h4-10H,1-3H3