(2S)-N-cycloheptyl-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCCC1)SC2=NC3=CC=CC=C3C(=O)N2C4CC4

Isomeric SMILES

C[C@@H](C(=O)NC1CCCCCC1)SC2=NC3=CC=CC=C3C(=O)N2C4CC4

InChI

InChI=1S/C21H27N3O2S/c1-14(19(25)22-15-8-4-2-3-5-9-15)27-21-23-18-11-7-6-10-17(18)20(26)24(21)16-12-13-16/h6-7,10-11,14-16H,2-5,8-9,12-13H2,1H3,(H,22,25)/t14-/m0/s1