2-[3-(2-acetamidoethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-methoxyphenyl)ethanamide

Systemtic Name: 2-[3-(2-acetamidoethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-[3-(2-acetamidoethyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(4-methoxyphenyl)acetamide CAS Name: 2-[[3-(2-acetamidoethyl)-4-oxo-2-quinazolinyl]thio]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-[3-(2-acetamidoethyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[[3-(2-acetamidoethyl)-4-keto-quinazolin-2-yl]thio]-N-(4-methoxyphenyl)acetamide Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)NCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22N4O4S/c1-14(26)22-11-12-25-20(28)17-5-3-4-6-18(17)24-21(25)30-13-19(27)23-15-7-9-16(29-2)10-8-15/h3-10H,11-13H2,1-2H3,(H,22,26)(H,23,27)