(2R)-2-[6-bromanyl-3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(methylcarbamoyl)propanamide

Systemtic Name: (2R)-2-[6-bromanyl-3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(methylcarbamoyl)propanamide Openeye Name: (2R)-2-[6-bromo-3-(3-ethoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(methylcarbamoyl)propanamide CAS Name: (2R)-2-[[6-bromo-3-(3-ethoxypropyl)-4-oxo-2-quinazolinyl]thio]-N-(methylcarbamoyl)propanamide IUPAC Name: (2R)-2-[6-bromo-3-(3-ethoxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(methylcarbamoyl)propanamide Traditional Name: (2R)-2-[[6-bromo-3-(3-ethoxypropyl)-4-keto-quinazolin-2-yl]thio]-N-(methylcarbamoyl)propionamide Formula: C18H23BrN4O4S MolecularWeight: 471.36862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23BrN4O4S/c1-4-27-9-5-8-23-16(25)13-10-12(19)6-7-14(13)21-18(23)28-11(2)15(24)22-17(26)20-3/h6-7,10-11H,4-5,8-9H2,1-3H3,(H2,20,22,24,26)/t11-/m1/s1