(2S)-2-[4-oxidanylidene-3-(3-phenylpropyl)quinazolin-2-yl]sulfanyl-N-(phenylmethyl)propanamide

Systemtic Name: (2S)-2-[4-oxidanylidene-3-(3-phenylpropyl)quinazolin-2-yl]sulfanyl-N-(phenylmethyl)propanamide Openeye Name: (2S)-N-benzyl-2-[4-oxo-3-(3-phenylpropyl)quinazolin-2-yl]sulfanyl-propanamide CAS Name: (2S)-2-[[4-oxo-3-(3-phenylpropyl)-2-quinazolinyl]thio]-N-(phenylmethyl)propanamide IUPAC Name: (2S)-N-benzyl-2-[4-oxo-3-(3-phenylpropyl)quinazolin-2-yl]sulfanylpropanamide Traditional Name: (2S)-N-benzyl-2-[[4-keto-3-(3-phenylpropyl)quinazolin-2-yl]thio]propionamide Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2CCCC4=CC=CC=C4

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2CCCC4=CC=CC=C4

InChI

InChI=1S/C27H27N3O2S/c1-20(25(31)28-19-22-13-6-3-7-14-22)33-27-29-24-17-9-8-16-23(24)26(32)30(27)18-10-15-21-11-4-2-5-12-21/h2-9,11-14,16-17,20H,10,15,18-19H2,1H3,(H,28,31)/t20-/m0/s1