10-(3-piperidin-1-ylpropanoyl)-3-propyl-5H-pyrazolo[3,4-c][1,5]benzodiazepin-4-one

Systemtic Name: 10-(3-piperidin-1-ylpropanoyl)-3-propyl-5H-pyrazolo[3,4-c][1,5]benzodiazepin-4-one Openeye Name: 10-[3-(1-piperidyl)propanoyl]-3-propyl-5H-pyrazolo[3,4-c][1,5]benzodiazepin-4-one CAS Name: 10-[1-oxo-3-(1-piperidinyl)propyl]-3-propyl-5H-pyrazolo[3,4-c][1,5]benzodiazepin-4-one IUPAC Name: 10-(3-piperidin-1-ylpropanoyl)-3-propyl-5H-pyrazolo[3,4-c][1,5]benzodiazepin-4-one Traditional Name: 10-(3-piperidinopropanoyl)-3-propyl-5H-pyrazolo[3,4-c][1,5]benzodiazepin-4-one Formula: C21H27N5O2 MolecularWeight: 381.47138

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=N1)N(C3=CC=CC=C3NC2=O)C(=O)CCN4CCCCC4

Isomeric SMILES

CCCN1C2=C(C=N1)N(C3=CC=CC=C3NC2=O)C(=O)CCN4CCCCC4

InChI

InChI=1S/C21H27N5O2/c1-2-11-25-20-18(15-22-25)26(17-9-5-4-8-16(17)23-21(20)28)19(27)10-14-24-12-6-3-7-13-24/h4-5,8-9,15H,2-3,6-7,10-14H2,1H3,(H,23,28)