1-[4-[[5-(indol-1-ylmethyl)-1H-pyrazol-3-yl]carbonyl]-1,4-diazepan-1-yl]ethanone

Systemtic Name: 1-[4-[[5-(indol-1-ylmethyl)-1H-pyrazol-3-yl]carbonyl]-1,4-diazepan-1-yl]ethanone Openeye Name: 1-[4-[5-(indol-1-ylmethyl)-1H-pyrazole-3-carbonyl]-1,4-diazepan-1-yl]ethanone CAS Name: 1-[4-[[5-(1-indolylmethyl)-1H-pyrazol-3-yl]-oxomethyl]-1,4-diazepan-1-yl]ethanone IUPAC Name: 1-[4-[5-(indol-1-ylmethyl)-1H-pyrazole-3-carbonyl]-1,4-diazepan-1-yl]ethanone Traditional Name: 1-[4-[5-(indol-1-ylmethyl)-1H-pyrazole-3-carbonyl]-1,4-diazepan-1-yl]ethanone Formula: C20H23N5O2 MolecularWeight: 365.42892

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCN(CC1)C(=O)C2=NNC(=C2)CN3C=CC4=CC=CC=C43

Isomeric SMILES

CC(=O)N1CCCN(CC1)C(=O)C2=NNC(=C2)CN3C=CC4=CC=CC=C43

InChI

InChI=1S/C20H23N5O2/c1-15(26)23-8-4-9-24(12-11-23)20(27)18-13-17(21-22-18)14-25-10-7-16-5-2-3-6-19(16)25/h2-3,5-7,10,13H,4,8-9,11-12,14H2,1H3,(H,21,22)