(2S)-2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(2-phenylphenyl)propanamide

Systemtic Name: (2S)-2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(2-phenylphenyl)propanamide Openeye Name: (2S)-2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(2-phenylphenyl)propanamide CAS Name: (2S)-2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]-N-(2-phenylphenyl)propanamide IUPAC Name: (2S)-2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanyl-N-(2-phenylphenyl)propanamide Traditional Name: (2S)-2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]-N-(2-phenylphenyl)propionamide Formula: C28H27N3O2S MolecularWeight: 469.59788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=O)N3C5CCCC5

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1C2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=O)N3C5CCCC5

InChI

InChI=1S/C28H27N3O2S/c1-19(26(32)29-24-17-9-7-15-22(24)20-11-3-2-4-12-20)34-28-30-25-18-10-8-16-23(25)27(33)31(28)21-13-5-6-14-21/h2-4,7-12,15-19,21H,5-6,13-14H2,1H3,(H,29,32)/t19-/m0/s1