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

Systemtic Name: (2R)-2-[6-bromanyl-3-(3-ethoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-cyclopentyl-propanamide Openeye Name: (2R)-2-[6-bromo-3-(3-ethoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-cyclopentyl-propanamide CAS Name: (2R)-2-[[6-bromo-3-(3-ethoxypropyl)-4-oxo-2-quinazolinyl]thio]-N-cyclopentylpropanamide IUPAC Name: (2R)-2-[6-bromo-3-(3-ethoxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-cyclopentylpropanamide Traditional Name: (2R)-2-[[6-bromo-3-(3-ethoxypropyl)-4-keto-quinazolin-2-yl]thio]-N-cyclopentyl-propionamide Formula: C21H28BrN3O3S MolecularWeight: 482.43432

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C)C(=O)NC3CCCC3

Isomeric SMILES

CCOCCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1S[C@H](C)C(=O)NC3CCCC3

InChI

InChI=1S/C21H28BrN3O3S/c1-3-28-12-6-11-25-20(27)17-13-15(22)9-10-18(17)24-21(25)29-14(2)19(26)23-16-7-4-5-8-16/h9-10,13-14,16H,3-8,11-12H2,1-2H3,(H,23,26)/t14-/m1/s1