2-[methylamino-[methyl-[4-(pyridin-4-ylmethyl)morpholin-2-yl]amino]methylidene]propanedinitrile

Systemtic Name: 2-[methylamino-[methyl-[4-(pyridin-4-ylmethyl)morpholin-2-yl]amino]methylidene]propanedinitrile Openeye Name: 2-[methylamino-[methyl-[4-(4-pyridylmethyl)morpholin-2-yl]amino]methylene]propanedinitrile CAS Name: 2-[methylamino-[methyl-[4-(pyridin-4-ylmethyl)-2-morpholinyl]amino]methylidene]propanedinitrile IUPAC Name: 2-[methylamino-[methyl-[4-(pyridin-4-ylmethyl)morpholin-2-yl]amino]methylidene]propanedinitrile Traditional Name: 2-[methylamino-[methyl-[4-(4-pyridylmethyl)morpholin-2-yl]amino]methylene]malononitrile Formula: C16H20N6O MolecularWeight: 312.3696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=C(C#N)C#N)N(C)C1CN(CCO1)CC2=CC=NC=C2

Isomeric SMILES

CNC(=C(C#N)C#N)N(C)C1CN(CCO1)CC2=CC=NC=C2

InChI

InChI=1S/C16H20N6O/c1-19-16(14(9-17)10-18)21(2)15-12-22(7-8-23-15)11-13-3-5-20-6-4-13/h3-6,15,19H,7-8,11-12H2,1-2H3