methyl N-[(2R)-2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanylpropanoyl]carbamate

Systemtic Name: methyl N-[(2R)-2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanylpropanoyl]carbamate Openeye Name: methyl N-[(2R)-2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanylpropanoyl]carbamate CAS Name: N-[(2R)-2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]-1-oxopropyl]carbamic acid methyl ester IUPAC Name: methyl N-[(2R)-2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanylpropanoyl]carbamate Traditional Name: N-[(2R)-2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]propanoyl]carbamic acid methyl ester Formula: C19H25N3O4S MolecularWeight: 391.4845

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC(=O)OC

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1S[C@H](C)C(=O)NC(=O)OC

InChI

InChI=1S/C19H25N3O4S/c1-4-5-6-9-12-22-17(24)14-10-7-8-11-15(14)20-18(22)27-13(2)16(23)21-19(25)26-3/h7-8,10-11,13H,4-6,9,12H2,1-3H3,(H,21,23,25)/t13-/m1/s1