3-cyclohexyl-5-phenyl-1-propyl-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8-one

Systemtic Name: 3-cyclohexyl-5-phenyl-1-propyl-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8-one Openeye Name: 3-cyclohexyl-5-phenyl-1-propyl-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8-one CAS Name: 3-cyclohexyl-5-phenyl-1-propyl-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8-one IUPAC Name: 3-cyclohexyl-5-phenyl-1-propyl-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8-one Traditional Name: 3-cyclohexyl-5-phenyl-1-propyl-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8-one Formula: C21H26N4O MolecularWeight: 350.45734

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=N1)C3CCCCC3)N=C(CNC2=O)C4=CC=CC=C4

Isomeric SMILES

CCCN1C2=C(C(=N1)C3CCCCC3)N=C(CNC2=O)C4=CC=CC=C4

InChI

InChI=1S/C21H26N4O/c1-2-13-25-20-19(18(24-25)16-11-7-4-8-12-16)23-17(14-22-21(20)26)15-9-5-3-6-10-15/h3,5-6,9-10,16H,2,4,7-8,11-14H2,1H3,(H,22,26)