(2R)-2-[6-bromanyl-3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-methyl-1,2-oxazol-5-yl)propanamide

Systemtic Name: (2R)-2-[6-bromanyl-3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(3-methyl-1,2-oxazol-5-yl)propanamide Openeye Name: (2R)-2-[6-bromo-3-(3-ethoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(3-methylisoxazol-5-yl)propanamide CAS Name: (2R)-2-[[6-bromo-3-(3-ethoxypropyl)-4-oxo-2-quinazolinyl]thio]-N-(3-methyl-5-isoxazolyl)propanamide IUPAC Name: (2R)-2-[6-bromo-3-(3-ethoxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(3-methyl-1,2-oxazol-5-yl)propanamide Traditional Name: (2R)-2-[[6-bromo-3-(3-ethoxypropyl)-4-keto-quinazolin-2-yl]thio]-N-(3-methylisoxazol-5-yl)propionamide Formula: C20H23BrN4O4S MolecularWeight: 495.39002

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C)C(=O)NC3=CC(=NO3)C

Isomeric SMILES

CCOCCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1S[C@H](C)C(=O)NC3=CC(=NO3)C

InChI

InChI=1S/C20H23BrN4O4S/c1-4-28-9-5-8-25-19(27)15-11-14(21)6-7-16(15)22-20(25)30-13(3)18(26)23-17-10-12(2)24-29-17/h6-7,10-11,13H,4-5,8-9H2,1-3H3,(H,23,26)/t13-/m1/s1