(2R)-2-[2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]-N-propyl-propanamide

Systemtic Name: (2R)-2-[2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]-N-propyl-propanamide Openeye Name: (2R)-2-[[2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]-N-propyl-propanamide CAS Name: (2R)-2-[[2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]amino]-N-propylpropanamide IUPAC Name: (2R)-2-[[2-(3-butyl-4-oxoquinazolin-2-yl)sulfanylacetyl]amino]-N-propylpropanamide Traditional Name: (2R)-2-[[2-[(3-butyl-4-keto-quinazolin-2-yl)thio]acetyl]amino]-N-propyl-propionamide Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(C)C(=O)NCCC

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N[C@H](C)C(=O)NCCC

InChI

InChI=1S/C20H28N4O3S/c1-4-6-12-24-19(27)15-9-7-8-10-16(15)23-20(24)28-13-17(25)22-14(3)18(26)21-11-5-2/h7-10,14H,4-6,11-13H2,1-3H3,(H,21,26)(H,22,25)/t14-/m1/s1