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

Systemtic Name: N-(3-methoxyphenyl)-2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-2-phenyl-ethanamide Openeye Name: 2-(3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(3-methoxyphenyl)-2-phenyl-acetamide CAS Name: N-(3-methoxyphenyl)-2-[[3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-2-phenylacetamide IUPAC Name: N-(3-methoxyphenyl)-2-[3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanyl-2-phenylacetamide Traditional Name: 2-[(3-isobutyl-4-keto-quinazolin-2-yl)thio]-N-(3-methoxyphenyl)-2-phenyl-acetamide Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SC(C3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)OC

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SC(C3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)OC

InChI

InChI=1S/C27H27N3O3S/c1-18(2)17-30-26(32)22-14-7-8-15-23(22)29-27(30)34-24(19-10-5-4-6-11-19)25(31)28-20-12-9-13-21(16-20)33-3/h4-16,18,24H,17H2,1-3H3,(H,28,31)