7-[(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one

Systemtic Name: 7-[(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one Openeye Name: 7-[(3-hexyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]thiazolo[3,2-a]pyrimidin-5-one CAS Name: 7-[[(3-hexyl-4-oxo-2-quinazolinyl)thio]methyl]-5-thiazolo[3,2-a]pyrimidinone IUPAC Name: 7-[(3-hexyl-4-oxoquinazolin-2-yl)sulfanylmethyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one Traditional Name: 7-[[(3-hexyl-4-keto-quinazolin-2-yl)thio]methyl]thiazolo[3,2-a]pyrimidin-5-one Formula: C21H22N4O2S2 MolecularWeight: 426.55498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=O)N4C=CSC4=N3

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=O)N4C=CSC4=N3

InChI

InChI=1S/C21H22N4O2S2/c1-2-3-4-7-10-25-19(27)16-8-5-6-9-17(16)23-21(25)29-14-15-13-18(26)24-11-12-28-20(24)22-15/h5-6,8-9,11-13H,2-4,7,10,14H2,1H3