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

Systemtic Name: (2R)-N-(methylcarbamoyl)-2-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-propanamide Openeye Name: (2R)-2-(3-benzyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(methylcarbamoyl)propanamide CAS Name: (2R)-N-(methylcarbamoyl)-2-[[4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]propanamide IUPAC Name: (2R)-2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanyl-N-(methylcarbamoyl)propanamide Traditional Name: (2R)-2-[(3-benzyl-4-keto-quinazolin-2-yl)thio]-N-(methylcarbamoyl)propionamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC)SC1=NC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC)SC1=NC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3

InChI

InChI=1S/C20H20N4O3S/c1-13(17(25)23-19(27)21-2)28-20-22-16-11-7-6-10-15(16)18(26)24(20)12-14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H2,21,23,25,27)/t13-/m1/s1