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

Systemtic Name: (2R)-2-[6-bromanyl-3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-cyclohexyl-propanamide Openeye Name: (2R)-2-[6-bromo-3-(3-ethoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-cyclohexyl-propanamide CAS Name: (2R)-2-[[6-bromo-3-(3-ethoxypropyl)-4-oxo-2-quinazolinyl]thio]-N-cyclohexylpropanamide IUPAC Name: (2R)-2-[6-bromo-3-(3-ethoxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-cyclohexylpropanamide Traditional Name: (2R)-2-[[6-bromo-3-(3-ethoxypropyl)-4-keto-quinazolin-2-yl]thio]-N-cyclohexyl-propionamide Formula: C22H30BrN3O3S MolecularWeight: 496.4609

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C)C(=O)NC3CCCCC3

Isomeric SMILES

CCOCCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1S[C@H](C)C(=O)NC3CCCCC3

InChI

InChI=1S/C22H30BrN3O3S/c1-3-29-13-7-12-26-21(28)18-14-16(23)10-11-19(18)25-22(26)30-15(2)20(27)24-17-8-5-4-6-9-17/h10-11,14-15,17H,3-9,12-13H2,1-2H3,(H,24,27)/t15-/m1/s1