(2R)-2-[6-bromanyl-3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanamide

Systemtic Name: (2R)-2-[6-bromanyl-3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanamide Openeye Name: (2R)-2-[6-bromo-3-(3-ethoxypropyl)-4-oxo-quinazolin-2-yl]sulfanylpropanamide CAS Name: (2R)-2-[[6-bromo-3-(3-ethoxypropyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: (2R)-2-[6-bromo-3-(3-ethoxypropyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: (2R)-2-[[6-bromo-3-(3-ethoxypropyl)-4-keto-quinazolin-2-yl]thio]propionamide Formula: C16H20BrN3O3S MolecularWeight: 414.3173

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C)C(=O)N

Isomeric SMILES

CCOCCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1S[C@H](C)C(=O)N

InChI

InChI=1S/C16H20BrN3O3S/c1-3-23-8-4-7-20-15(22)12-9-11(17)5-6-13(12)19-16(20)24-10(2)14(18)21/h5-6,9-10H,3-4,7-8H2,1-2H3,(H2,18,21)/t10-/m1/s1