ethyl 4-(7-fluoranyl-2-methyl-1H-pyrazolo[4,3-c][1,5]benzodiazepin-4-yl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(7-fluoranyl-2-methyl-1H-pyrazolo[4,3-c][1,5]benzodiazepin-4-yl)piperazine-1-carboxylate Openeye Name: ethyl 4-(7-fluoro-2-methyl-1H-pyrazolo[4,3-c][1,5]benzodiazepin-4-yl)piperazine-1-carboxylate CAS Name: 4-(7-fluoro-2-methyl-1H-pyrazolo[4,3-c][1,5]benzodiazepin-4-yl)-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(7-fluoro-2-methyl-1H-pyrazolo[4,3-c][1,5]benzodiazepin-4-yl)piperazine-1-carboxylate Traditional Name: 4-(7-fluoro-2-methyl-1H-pyrazolo[4,3-c][1,5]benzodiazepin-4-yl)piperazine-1-carboxylic acid ethyl ester Formula: C18H21FN6O2 MolecularWeight: 372.396743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NC3=C(C=CC(=C3)F)N=C4C2=CN(N4)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NC3=C(C=CC(=C3)F)N=C4C2=CN(N4)C

InChI

InChI=1S/C18H21FN6O2/c1-3-27-18(26)25-8-6-24(7-9-25)17-13-11-23(2)22-16(13)20-14-5-4-12(19)10-15(14)21-17/h4-5,10-11H,3,6-9H2,1-2H3,(H,20,22)