3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[(S)-(4-methylphenyl)-thiophen-2-yl-methyl]propanamide

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[(S)-(4-methylphenyl)-thiophen-2-yl-methyl]propanamide Openeye Name: 3-(6-bromo-4-oxo-quinazolin-3-yl)-N-[(S)-p-tolyl(2-thienyl)methyl]propanamide CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)-N-[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]propanamide IUPAC Name: 3-(6-bromo-4-oxoquinazolin-3-yl)-N-[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]propanamide Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)-N-[(S)-p-tolyl(2-thienyl)methyl]propionamide Formula: C23H20BrN3O2S MolecularWeight: 482.3928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](C2=CC=CS2)NC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C23H20BrN3O2S/c1-15-4-6-16(7-5-15)22(20-3-2-12-30-20)26-21(28)10-11-27-14-25-19-9-8-17(24)13-18(19)23(27)29/h2-9,12-14,22H,10-11H2,1H3,(H,26,28)/t22-/m0/s1