7-(4-bromophenyl)-1-cyclopentyl-3-ethyl-5,6-dihydropyrazolo[3,4-e][1,4]diazepin-4-one

Systemtic Name: 7-(4-bromophenyl)-1-cyclopentyl-3-ethyl-5,6-dihydropyrazolo[3,4-e][1,4]diazepin-4-one Openeye Name: 7-(4-bromophenyl)-1-cyclopentyl-3-ethyl-5,6-dihydropyrazolo[3,4-e][1,4]diazepin-4-one CAS Name: 7-(4-bromophenyl)-1-cyclopentyl-3-ethyl-5,6-dihydropyrazolo[3,4-e][1,4]diazepin-4-one IUPAC Name: 7-(4-bromophenyl)-1-cyclopentyl-3-ethyl-5,6-dihydropyrazolo[3,4-e][1,4]diazepin-4-one Traditional Name: 7-(4-bromophenyl)-1-cyclopentyl-3-ethyl-5,6-dihydropyrazolo[3,4-e][1,4]diazepin-4-one Formula: C19H21BrN4O MolecularWeight: 401.30024

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C2=C1C(=O)NCC(=N2)C3=CC=C(C=C3)Br)C4CCCC4

Isomeric SMILES

CCC1=NN(C2=C1C(=O)NCC(=N2)C3=CC=C(C=C3)Br)C4CCCC4

InChI

InChI=1S/C19H21BrN4O/c1-2-15-17-18(24(23-15)14-5-3-4-6-14)22-16(11-21-19(17)25)12-7-9-13(20)10-8-12/h7-10,14H,2-6,11H2,1H3,(H,21,25)