N-(4-ethoxyphenyl)-2-(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-quinazolin-1-yl)ethanamide

Systemtic Name: N-(4-ethoxyphenyl)-2-(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-quinazolin-1-yl)ethanamide Openeye Name: 2-(3-allyl-4-oxo-2-thioxo-quinazolin-1-yl)-N-(4-ethoxyphenyl)acetamide CAS Name: N-(4-ethoxyphenyl)-2-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1-quinazolinyl)acetamide IUPAC Name: N-(4-ethoxyphenyl)-2-(4-oxo-3-prop-2-enyl-2-sulfanylidenequinazolin-1-yl)acetamide Traditional Name: 2-(3-allyl-4-keto-2-thioxo-quinazolin-1-yl)-N-p-phenetyl-acetamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3C(=O)N(C2=S)CC=C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CN2C3=CC=CC=C3C(=O)N(C2=S)CC=C

InChI

InChI=1S/C21H21N3O3S/c1-3-13-23-20(26)17-7-5-6-8-18(17)24(21(23)28)14-19(25)22-15-9-11-16(12-10-15)27-4-2/h3,5-12H,1,4,13-14H2,2H3,(H,22,25)