(2R)-2-[6-bromanyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(1R)-1-phenylethyl]propanamide

Systemtic Name: (2R)-2-[6-bromanyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(1R)-1-phenylethyl]propanamide Openeye Name: (2R)-2-[6-bromo-3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[(1R)-1-phenylethyl]propanamide CAS Name: (2R)-2-[[6-bromo-3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]thio]-N-[(1R)-1-phenylethyl]propanamide IUPAC Name: (2R)-2-[6-bromo-3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(1R)-1-phenylethyl]propanamide Traditional Name: (2R)-2-[[6-bromo-4-keto-3-(2-methoxyethyl)quinazolin-2-yl]thio]-N-[(1R)-1-phenylethyl]propionamide Formula: C22H24BrN3O3S MolecularWeight: 490.41326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(C)SC2=NC3=C(C=C(C=C3)Br)C(=O)N2CCOC

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)[C@@H](C)SC2=NC3=C(C=C(C=C3)Br)C(=O)N2CCOC

InChI

InChI=1S/C22H24BrN3O3S/c1-14(16-7-5-4-6-8-16)24-20(27)15(2)30-22-25-19-10-9-17(23)13-18(19)21(28)26(22)11-12-29-3/h4-10,13-15H,11-12H2,1-3H3,(H,24,27)/t14-,15-/m1/s1