2-[1-[2-[[5-(azepan-1-ylmethyl)furan-2-yl]methylamino]ethyl]imidazolidin-2-ylidene]propanedinitrile

Systemtic Name: 2-[1-[2-[[5-(azepan-1-ylmethyl)furan-2-yl]methylamino]ethyl]imidazolidin-2-ylidene]propanedinitrile Openeye Name: 2-[1-[2-[[5-(azepan-1-ylmethyl)-2-furyl]methylamino]ethyl]imidazolidin-2-ylidene]propanedinitrile CAS Name: 2-[1-[2-[[5-(1-azepanylmethyl)-2-furanyl]methylamino]ethyl]-2-imidazolidinylidene]propanedinitrile IUPAC Name: 2-[1-[2-[[5-(azepan-1-ylmethyl)furan-2-yl]methylamino]ethyl]imidazolidin-2-ylidene]propanedinitrile Traditional Name: 2-[1-[2-[[5-(azepan-1-ylmethyl)-2-furyl]methylamino]ethyl]imidazolidin-2-ylidene]malononitrile Formula: C20H28N6O MolecularWeight: 368.47592

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=CC=C(O2)CNCCN3CCNC3=C(C#N)C#N

Isomeric SMILES

C1CCCN(CC1)CC2=CC=C(O2)CNCCN3CCNC3=C(C#N)C#N

InChI

InChI=1S/C20H28N6O/c21-13-17(14-22)20-24-8-12-26(20)11-7-23-15-18-5-6-19(27-18)16-25-9-3-1-2-4-10-25/h5-6,23-24H,1-4,7-12,15-16H2