(2S)-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(methylcarbamoyl)-2-phenyl-ethanamide

Systemtic Name: (2S)-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(methylcarbamoyl)-2-phenyl-ethanamide Openeye Name: (2S)-2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(methylcarbamoyl)-2-phenyl-acetamide CAS Name: (2S)-2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]-N-(methylcarbamoyl)-2-phenylacetamide IUPAC Name: (2S)-2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanyl-N-(methylcarbamoyl)-2-phenylacetamide Traditional Name: (2S)-2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]-N-(methylcarbamoyl)-2-phenyl-acetamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)C(C1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2C4CC4

Isomeric SMILES

CNC(=O)NC(=O)[C@H](C1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2C4CC4

InChI

InChI=1S/C21H20N4O3S/c1-22-20(28)24-18(26)17(13-7-3-2-4-8-13)29-21-23-16-10-6-5-9-15(16)19(27)25(21)14-11-12-14/h2-10,14,17H,11-12H2,1H3,(H2,22,24,26,28)/t17-/m0/s1