N-(6-bromanyl-4-oxidanylidene-2-thiophen-2-yl-1,2-dihydroquinazolin-3-yl)-4-phenylmethoxy-benzamide

Systemtic Name: N-(6-bromanyl-4-oxidanylidene-2-thiophen-2-yl-1,2-dihydroquinazolin-3-yl)-4-phenylmethoxy-benzamide Openeye Name: 4-benzyloxy-N-[6-bromo-4-oxo-2-(2-thienyl)-1,2-dihydroquinazolin-3-yl]benzamide CAS Name: N-(6-bromo-4-oxo-2-thiophen-2-yl-1,2-dihydroquinazolin-3-yl)-4-phenylmethoxybenzamide IUPAC Name: N-(6-bromo-4-oxo-2-thiophen-2-yl-1,2-dihydroquinazolin-3-yl)-4-phenylmethoxybenzamide Traditional Name: 4-benzoxy-N-[6-bromo-4-keto-2-(2-thienyl)-1,2-dihydroquinazolin-3-yl]benzamide Formula: C26H20BrN3O3S MolecularWeight: 534.4243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NN3C(NC4=C(C3=O)C=C(C=C4)Br)C5=CC=CS5

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)NN3C(NC4=C(C3=O)C=C(C=C4)Br)C5=CC=CS5

InChI

InChI=1S/C26H20BrN3O3S/c27-19-10-13-22-21(15-19)26(32)30(24(28-22)23-7-4-14-34-23)29-25(31)18-8-11-20(12-9-18)33-16-17-5-2-1-3-6-17/h1-15,24,28H,16H2,(H,29,31)