3-methyl-4-oxidanylidene-2-sulfanylidene-N-[(2,4,5-trimethoxyphenyl)methyl]-1H-quinazoline-7-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-2-sulfanylidene-N-[(2,4,5-trimethoxyphenyl)methyl]-1H-quinazoline-7-carboxamide Openeye Name: 3-methyl-4-oxo-2-thioxo-N-[(2,4,5-trimethoxyphenyl)methyl]-1H-quinazoline-7-carboxamide CAS Name: 3-methyl-4-oxo-2-sulfanylidene-N-[(2,4,5-trimethoxyphenyl)methyl]-1H-quinazoline-7-carboxamide IUPAC Name: 3-methyl-4-oxo-2-sulfanylidene-N-[(2,4,5-trimethoxyphenyl)methyl]-1H-quinazoline-7-carboxamide Traditional Name: 4-keto-3-methyl-2-thioxo-N-(2,4,5-trimethoxybenzyl)-1H-quinazoline-7-carboxamide Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC(=C(C=C3OC)OC)OC)NC1=S

Isomeric SMILES

CN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC(=C(C=C3OC)OC)OC)NC1=S

InChI

InChI=1S/C20H21N3O5S/c1-23-19(25)13-6-5-11(7-14(13)22-20(23)29)18(24)21-10-12-8-16(27-3)17(28-4)9-15(12)26-2/h5-9H,10H2,1-4H3,(H,21,24)(H,22,29)