(2R)-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(1S,2S)-2-methylcyclohexyl]propanamide

Systemtic Name: (2R)-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(1S,2S)-2-methylcyclohexyl]propanamide Openeye Name: (2R)-2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[(1S,2S)-2-methylcyclohexyl]propanamide CAS Name: (2R)-2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]-N-[(1S,2S)-2-methylcyclohexyl]propanamide IUPAC Name: (2R)-2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanyl-N-[(1S,2S)-2-methylcyclohexyl]propanamide Traditional Name: (2R)-2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]-N-[(1S,2S)-2-methylcyclohexyl]propionamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4CC4

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)[C@@H](C)SC2=NC3=CC=CC=C3C(=O)N2C4CC4

InChI

InChI=1S/C21H27N3O2S/c1-13-7-3-5-9-17(13)22-19(25)14(2)27-21-23-18-10-6-4-8-16(18)20(26)24(21)15-11-12-15/h4,6,8,10,13-15,17H,3,5,7,9,11-12H2,1-2H3,(H,22,25)/t13-,14+,17-/m0/s1