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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)SC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)NC1CC1)SC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4

InChI

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