N-(2-ethoxyphenyl)-2-[3-(1-methoxypropan-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-2-phenyl-ethanamide

Systemtic Name: N-(2-ethoxyphenyl)-2-[3-(1-methoxypropan-2-yl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-2-phenyl-ethanamide Openeye Name: N-(2-ethoxyphenyl)-2-[3-(2-methoxy-1-methyl-ethyl)-4-oxo-quinazolin-2-yl]sulfanyl-2-phenyl-acetamide CAS Name: N-(2-ethoxyphenyl)-2-[[3-(1-methoxypropan-2-yl)-4-oxo-2-quinazolinyl]thio]-2-phenylacetamide IUPAC Name: N-(2-ethoxyphenyl)-2-[3-(1-methoxypropan-2-yl)-4-oxoquinazolin-2-yl]sulfanyl-2-phenylacetamide Traditional Name: 2-[[4-keto-3-(2-methoxy-1-methyl-ethyl)quinazolin-2-yl]thio]-N-o-phenetyl-2-phenyl-acetamide Formula: C28H29N3O4S MolecularWeight: 503.61256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=O)N3C(C)COC

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C(C2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=O)N3C(C)COC

InChI

InChI=1S/C28H29N3O4S/c1-4-35-24-17-11-10-16-23(24)29-26(32)25(20-12-6-5-7-13-20)36-28-30-22-15-9-8-14-21(22)27(33)31(28)19(2)18-34-3/h5-17,19,25H,4,18H2,1-3H3,(H,29,32)