2-(3-azanyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(3,5-dimethoxyphenyl)ethanamide

Systemtic Name: 2-(3-azanyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(3,5-dimethoxyphenyl)ethanamide Openeye Name: 2-(3-amino-4-oxo-quinazolin-2-yl)sulfanyl-N-(3,5-dimethoxyphenyl)acetamide CAS Name: 2-[(3-amino-4-oxo-2-quinazolinyl)thio]-N-(3,5-dimethoxyphenyl)acetamide IUPAC Name: 2-(3-amino-4-oxoquinazolin-2-yl)sulfanyl-N-(3,5-dimethoxyphenyl)acetamide Traditional Name: 2-[(3-amino-4-keto-quinazolin-2-yl)thio]-N-(3,5-dimethoxyphenyl)acetamide Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2N)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2N)OC

InChI

InChI=1S/C18H18N4O4S/c1-25-12-7-11(8-13(9-12)26-2)20-16(23)10-27-18-21-15-6-4-3-5-14(15)17(24)22(18)19/h3-9H,10,19H2,1-2H3,(H,20,23)