(2S)-2-[6-bromanyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-cyclopropyl-2-phenyl-ethanamide

Systemtic Name: (2S)-2-[6-bromanyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-cyclopropyl-2-phenyl-ethanamide Openeye Name: (2S)-2-(6-bromo-3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-N-cyclopropyl-2-phenyl-acetamide CAS Name: (2S)-2-[[6-bromo-3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-N-cyclopropyl-2-phenylacetamide IUPAC Name: (2S)-2-[6-bromo-3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-cyclopropyl-2-phenylacetamide Traditional Name: (2S)-2-[(6-bromo-3-isobutyl-4-keto-quinazolin-2-yl)thio]-N-cyclopropyl-2-phenyl-acetamide Formula: C23H24BrN3O2S MolecularWeight: 486.42456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C3=CC=CC=C3)C(=O)NC4CC4

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=CC(=C2)Br)N=C1S[C@@H](C3=CC=CC=C3)C(=O)NC4CC4

InChI

InChI=1S/C23H24BrN3O2S/c1-14(2)13-27-22(29)18-12-16(24)8-11-19(18)26-23(27)30-20(15-6-4-3-5-7-15)21(28)25-17-9-10-17/h3-8,11-12,14,17,20H,9-10,13H2,1-2H3,(H,25,28)/t20-/m0/s1