N-aminocarbonyl-3-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-aminocarbonyl-3-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-carbamoyl-3-[3-(3-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-carbamoyl-3-[[3-(3-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-carbamoyl-3-[3-(3-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-carbamoyl-3-[[3-(3-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]propionamide Formula: C15H18N4O4S MolecularWeight: 350.39282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCC(=O)NC(=O)N)CCCO

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCC(=O)NC(=O)N)CCCO

InChI

InChI=1S/C15H18N4O4S/c16-14(23)18-12(21)6-9-24-15-17-11-5-2-1-4-10(11)13(22)19(15)7-3-8-20/h1-2,4-5,20H,3,6-9H2,(H3,16,18,21,23)