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

Systemtic Name: (2S)-2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(2S)-2-phenylpropyl]propanamide Openeye Name: (2S)-2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[(2S)-2-phenylpropyl]propanamide CAS Name: (2S)-2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]-N-[(2S)-2-phenylpropyl]propanamide IUPAC Name: (2S)-2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanyl-N-[(2S)-2-phenylpropyl]propanamide Traditional Name: (2S)-2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]-N-[(2S)-2-phenylpropyl]propionamide Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C(C)SC1=NC2=CC=CC=C2C(=O)N1C3CCCC3)C4=CC=CC=C4

Isomeric SMILES

C[C@H](CNC(=O)[C@H](C)SC1=NC2=CC=CC=C2C(=O)N1C3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C25H29N3O2S/c1-17(19-10-4-3-5-11-19)16-26-23(29)18(2)31-25-27-22-15-9-8-14-21(22)24(30)28(25)20-12-6-7-13-20/h3-5,8-11,14-15,17-18,20H,6-7,12-13,16H2,1-2H3,(H,26,29)/t17-,18+/m1/s1