N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-(4-oxidanylidenequinazolin-3-yl)benzamide

Systemtic Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-(4-oxidanylidenequinazolin-3-yl)benzamide Openeye Name: N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-4-(4-oxoquinazolin-3-yl)benzamide CAS Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-(4-oxo-3-quinazolinyl)benzamide IUPAC Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-(4-oxoquinazolin-3-yl)benzamide Traditional Name: N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-4-(4-ketoquinazolin-3-yl)benzamide Formula: C21H19N5O2S MolecularWeight: 405.47286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)N3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)CC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)N3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C21H19N5O2S/c1-13(2)11-18-24-25-21(29-18)23-19(27)14-7-9-15(10-8-14)26-12-22-17-6-4-3-5-16(17)20(26)28/h3-10,12-13H,11H2,1-2H3,(H,23,25,27)