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

Systemtic Name: 4-oxidanylidene-N-[(3-phenoxyphenyl)methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 4-oxo-N-[(3-phenoxyphenyl)methyl]-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 4-oxo-N-[(3-phenoxyphenyl)methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 4-oxo-N-[(3-phenoxyphenyl)methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 4-keto-N-(3-phenoxybenzyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C22H17N3O3S MolecularWeight: 403.45368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)CNC(=O)C3=CC4=C(C=C3)C(=O)NC(=S)N4

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)CNC(=O)C3=CC4=C(C=C3)C(=O)NC(=S)N4

InChI

InChI=1S/C22H17N3O3S/c26-20(15-9-10-18-19(12-15)24-22(29)25-21(18)27)23-13-14-5-4-8-17(11-14)28-16-6-2-1-3-7-16/h1-12H,13H2,(H,23,26)(H2,24,25,27,29)