3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: 3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)-N-[5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: 3-(6-bromo-4-oxo-quinazolin-3-yl)-N-[5-(4-isopropylphenyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: 3-(6-bromo-4-oxo-3-quinazolinyl)-N-[5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 3-(6-bromo-4-oxoquinazolin-3-yl)-N-[5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: 3-(6-bromo-4-keto-quinazolin-3-yl)-N-(5-p-cumenyl-1,3,4-thiadiazol-2-yl)propionamide Formula: C22H20BrN5O2S MolecularWeight: 498.3955

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NN=C(S2)NC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NN=C(S2)NC(=O)CCN3C=NC4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C22H20BrN5O2S/c1-13(2)14-3-5-15(6-4-14)20-26-27-22(31-20)25-19(29)9-10-28-12-24-18-8-7-16(23)11-17(18)21(28)30/h3-8,11-13H,9-10H2,1-2H3,(H,25,27,29)