1-ethyl-3-propan-2-yl-5-(4-pyrrolidin-1-ylphenyl)-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8-one

Systemtic Name: 1-ethyl-3-propan-2-yl-5-(4-pyrrolidin-1-ylphenyl)-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8-one Openeye Name: 1-ethyl-3-isopropyl-5-(4-pyrrolidin-1-ylphenyl)-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8-one CAS Name: 1-ethyl-3-propan-2-yl-5-[4-(1-pyrrolidinyl)phenyl]-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8-one IUPAC Name: 1-ethyl-3-propan-2-yl-5-(4-pyrrolidin-1-ylphenyl)-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8-one Traditional Name: 1-ethyl-3-isopropyl-5-(4-pyrrolidinophenyl)-6,7-dihydropyrazolo[4,3-e][1,4]diazepin-8-one Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=N1)C(C)C)N=C(CNC2=O)C3=CC=C(C=C3)N4CCCC4

Isomeric SMILES

CCN1C2=C(C(=N1)C(C)C)N=C(CNC2=O)C3=CC=C(C=C3)N4CCCC4

InChI

InChI=1S/C21H27N5O/c1-4-26-20-19(18(24-26)14(2)3)23-17(13-22-21(20)27)15-7-9-16(10-8-15)25-11-5-6-12-25/h7-10,14H,4-6,11-13H2,1-3H3,(H,22,27)