2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-phenylphenyl)propanamide

Systemtic Name: 2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-phenylphenyl)propanamide Openeye Name: 2-(3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(2-phenylphenyl)propanamide CAS Name: 2-[[3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-N-(2-phenylphenyl)propanamide IUPAC Name: 2-[3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2-phenylphenyl)propanamide Traditional Name: 2-[(3-isobutyl-4-keto-quinazolin-2-yl)thio]-N-(2-phenylphenyl)propionamide Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=CC=C3C4=CC=CC=C4

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=CC=C3C4=CC=CC=C4

InChI

InChI=1S/C27H27N3O2S/c1-18(2)17-30-26(32)22-14-8-10-16-24(22)29-27(30)33-19(3)25(31)28-23-15-9-7-13-21(23)20-11-5-4-6-12-20/h4-16,18-19H,17H2,1-3H3,(H,28,31)