2-[methylamino-[piperidin-1-yl-[[5-(piperidin-1-ylmethyl)furan-2-yl]methyl]amino]methylidene]propanedinitrile

Systemtic Name: 2-[methylamino-[piperidin-1-yl-[[5-(piperidin-1-ylmethyl)furan-2-yl]methyl]amino]methylidene]propanedinitrile Openeye Name: 2-[methylamino-[1-piperidyl-[[5-(1-piperidylmethyl)-2-furyl]methyl]amino]methylene]propanedinitrile CAS Name: 2-[methylamino-[1-piperidinyl-[[5-(1-piperidinylmethyl)-2-furanyl]methyl]amino]methylidene]propanedinitrile IUPAC Name: 2-[methylamino-[piperidin-1-yl-[[5-(piperidin-1-ylmethyl)furan-2-yl]methyl]amino]methylidene]propanedinitrile Traditional Name: 2-[methylamino-[piperidino-[[5-(piperidinomethyl)-2-furyl]methyl]amino]methylene]malononitrile Formula: C21H30N6O MolecularWeight: 382.5025

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=C(C#N)C#N)N(CC1=CC=C(O1)CN2CCCCC2)N3CCCCC3

Isomeric SMILES

CNC(=C(C#N)C#N)N(CC1=CC=C(O1)CN2CCCCC2)N3CCCCC3

InChI

InChI=1S/C21H30N6O/c1-24-21(18(14-22)15-23)27(26-12-6-3-7-13-26)17-20-9-8-19(28-20)16-25-10-4-2-5-11-25/h8-9,24H,2-7,10-13,16-17H2,1H3