3-tert-butyl-1-propyl-5-(4-pyrrolidin-1-ylphenyl)-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8-one

Systemtic Name: 3-tert-butyl-1-propyl-5-(4-pyrrolidin-1-ylphenyl)-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8-one Openeye Name: 3-tert-butyl-1-propyl-5-(4-pyrrolidin-1-ylphenyl)-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8-one CAS Name: 3-tert-butyl-1-propyl-5-[4-(1-pyrrolidinyl)phenyl]-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8-one IUPAC Name: 3-tert-butyl-1-propyl-5-(4-pyrrolidin-1-ylphenyl)-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8-one Traditional Name: 3-tert-butyl-1-propyl-5-(4-pyrrolidinophenyl)-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8-one Formula: C23H31N5O MolecularWeight: 393.52514

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=N1)C(C)(C)C)N=C(CNC2=O)C3=CC=C(C=C3)N4CCCC4

Isomeric SMILES

CCCN1C2=C(C(=N1)C(C)(C)C)N=C(CNC2=O)C3=CC=C(C=C3)N4CCCC4

InChI

InChI=1S/C23H31N5O/c1-5-12-28-20-19(21(26-28)23(2,3)4)25-18(15-24-22(20)29)16-8-10-17(11-9-16)27-13-6-7-14-27/h8-11H,5-7,12-15H2,1-4H3,(H,24,29)