4-tert-butyl-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-5H-[1,2,5]triazepino[5,4-a]indol-1-one

Systemtic Name: 4-tert-butyl-2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)-5H-[1,2,5]triazepino[5,4-a]indol-1-one Openeye Name: 4-tert-butyl-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)-5H-[1,2,5]triazepino[5,4-a]indol-1-one CAS Name: 4-tert-butyl-2-[2-oxo-2-(1-pyrrolidinyl)ethyl]-5H-[1,2,5]triazepino[5,4-a]indol-1-one IUPAC Name: 4-tert-butyl-2-(2-oxo-2-pyrrolidin-1-ylethyl)-5H-[1,2,5]triazepino[5,4-a]indol-1-one Traditional Name: 4-tert-butyl-2-(2-keto-2-pyrrolidino-ethyl)-5H-[1,2,5]triazepin[5,4-a]indol-1-one Formula: C21H26N4O2 MolecularWeight: 366.45674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=O)C2=CC3=CC=CC=C3N2C1)CC(=O)N4CCCC4

Isomeric SMILES

CC(C)(C)C1=NN(C(=O)C2=CC3=CC=CC=C3N2C1)CC(=O)N4CCCC4

InChI

InChI=1S/C21H26N4O2/c1-21(2,3)18-13-24-16-9-5-4-8-15(16)12-17(24)20(27)25(22-18)14-19(26)23-10-6-7-11-23/h4-5,8-9,12H,6-7,10-11,13-14H2,1-3H3