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

Systemtic Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-[4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-[[4-oxo-3-(2-oxolanylmethyl)-2-quinazolinyl]thio]acetamide IUPAC Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-[4-oxo-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanylacetamide Traditional Name: N-[2-(3,4-diethoxyphenyl)ethyl]-2-[[4-keto-3-(tetrahydrofurfuryl)quinazolin-2-yl]thio]acetamide Formula: C27H33N3O5S MolecularWeight: 511.63302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4CCCO4)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4CCCO4)OCC

InChI

InChI=1S/C27H33N3O5S/c1-3-33-23-12-11-19(16-24(23)34-4-2)13-14-28-25(31)18-36-27-29-22-10-6-5-9-21(22)26(32)30(27)17-20-8-7-15-35-20/h5-6,9-12,16,20H,3-4,7-8,13-15,17-18H2,1-2H3,(H,28,31)