(2R)-N-(cyclopentylcarbamoyl)-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(cyclopentylcarbamoyl)-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: (2R)-2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(cyclopentylcarbamoyl)propanamide CAS Name: (2R)-N-[(cyclopentylamino)-oxomethyl]-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]propanamide IUPAC Name: (2R)-N-(cyclopentylcarbamoyl)-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylpropanamide Traditional Name: (2R)-2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-(cyclopentylcarbamoyl)propionamide Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CCCC1)SC2=NC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC1CCCC1)SC2=NC3=CC=CC=C3C(=O)N2CC=C

InChI

InChI=1S/C20H24N4O3S/c1-3-12-24-18(26)15-10-6-7-11-16(15)22-20(24)28-13(2)17(25)23-19(27)21-14-8-4-5-9-14/h3,6-7,10-11,13-14H,1,4-5,8-9,12H2,2H3,(H2,21,23,25,27)/t13-/m1/s1