1-(1H-indazol-6-yl)-2-[2-oxidanylidene-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)azepan-3-yl]guanidine

Systemtic Name: 1-(1H-indazol-6-yl)-2-[2-oxidanylidene-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)azepan-3-yl]guanidine Openeye Name: 1-(1H-indazol-6-yl)-2-[2-oxo-1-(2-oxo-2-pyrrolidin-1-yl-ethyl)azepan-3-yl]guanidine CAS Name: 1-(1H-indazol-6-yl)-2-[2-oxo-1-[2-oxo-2-(1-pyrrolidinyl)ethyl]-3-azepanyl]guanidine IUPAC Name: 1-(1H-indazol-6-yl)-2-[2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]guanidine Traditional Name: 1-(1H-indazol-6-yl)-2-[2-keto-1-(2-keto-2-pyrrolidino-ethyl)azepan-3-yl]guanidine Formula: C20H27N7O2 MolecularWeight: 397.47408

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C(C1)N=C(N)NC2=CC3=C(C=C2)C=NN3)CC(=O)N4CCCC4

Isomeric SMILES

C1CCN(C(=O)C(C1)N=C(N)NC2=CC3=C(C=C2)C=NN3)CC(=O)N4CCCC4

InChI

InChI=1S/C20H27N7O2/c21-20(23-15-7-6-14-12-22-25-17(14)11-15)24-16-5-1-2-10-27(19(16)29)13-18(28)26-8-3-4-9-26/h6-7,11-12,16H,1-5,8-10,13H2,(H,22,25)(H3,21,23,24)