N-[2-(3,4-diethoxyphenyl)ethyl]-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-[(3-methyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-[(4-keto-3-methyl-quinazolin-2-yl)thio]acetamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C)OCC

InChI

InChI=1S/C23H27N3O4S/c1-4-29-19-11-10-16(14-20(19)30-5-2)12-13-24-21(27)15-31-23-25-18-9-7-6-8-17(18)22(28)26(23)3/h6-11,14H,4-5,12-13,15H2,1-3H3,(H,24,27)