7-bromanyl-1-cyclopentyl-4-(phenylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Systemtic Name: 7-bromanyl-1-cyclopentyl-4-(phenylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 4-benzyl-7-bromo-1-cyclopentyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 7-bromo-1-cyclopentyl-4-(phenylmethyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 4-benzyl-7-bromo-1-cyclopentyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 4-benzyl-7-bromo-1-cyclopentyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C21H19BrN4O MolecularWeight: 423.30576

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=NN=C3N2C4=C(C=C(C=C4)Br)C(=O)N3CC5=CC=CC=C5

Isomeric SMILES

C1CCC(C1)C2=NN=C3N2C4=C(C=C(C=C4)Br)C(=O)N3CC5=CC=CC=C5

InChI

InChI=1S/C21H19BrN4O/c22-16-10-11-18-17(12-16)20(27)25(13-14-6-2-1-3-7-14)21-24-23-19(26(18)21)15-8-4-5-9-15/h1-3,6-7,10-12,15H,4-5,8-9,13H2