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

Systemtic Name: (2R)-2-[6-bromanyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-cyclopentyl-propanamide Openeye Name: (2R)-2-(6-bromo-3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-N-cyclopentyl-propanamide CAS Name: (2R)-2-[[6-bromo-3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-N-cyclopentylpropanamide IUPAC Name: (2R)-2-[6-bromo-3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-cyclopentylpropanamide Traditional Name: (2R)-2-[(6-bromo-3-isobutyl-4-keto-quinazolin-2-yl)thio]-N-cyclopentyl-propionamide Formula: C20H26BrN3O2S MolecularWeight: 452.40834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C)C(=O)NC3CCCC3

Isomeric SMILES

C[C@H](C(=O)NC1CCCC1)SC2=NC3=C(C=C(C=C3)Br)C(=O)N2CC(C)C

InChI

InChI=1S/C20H26BrN3O2S/c1-12(2)11-24-19(26)16-10-14(21)8-9-17(16)23-20(24)27-13(3)18(25)22-15-6-4-5-7-15/h8-10,12-13,15H,4-7,11H2,1-3H3,(H,22,25)/t13-/m1/s1