(2R)-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(phenylmethyl)propanamide

Systemtic Name: (2R)-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(phenylmethyl)propanamide Openeye Name: (2R)-N-benzyl-2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: (2R)-2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]-N-(phenylmethyl)propanamide IUPAC Name: (2R)-N-benzyl-2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-benzyl-2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2C4CC4

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2C4CC4

InChI

InChI=1S/C21H21N3O2S/c1-14(19(25)22-13-15-7-3-2-4-8-15)27-21-23-18-10-6-5-9-17(18)20(26)24(21)16-11-12-16/h2-10,14,16H,11-13H2,1H3,(H,22,25)/t14-/m1/s1