2-(4-azanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)-2-(4-dimethylaminophenyl)imino-ethanenitrile

Systemtic Name: 2-(4-azanyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl)-2-(4-dimethylaminophenyl)imino-ethanenitrile Openeye Name: 4-amino-N-(4-dimethylaminophenyl)-6-pyrrolidin-1-yl-1,3,5-triazine-2-carboximidoyl cyanide CAS Name: 2-[4-amino-6-(1-pyrrolidinyl)-1,3,5-triazin-2-yl]-2-(4-dimethylaminophenyl)iminoacetonitrile IUPAC Name: 4-amino-N-(4-dimethylaminophenyl)-6-pyrrolidin-1-yl-1,3,5-triazine-2-carboximidoyl cyanide Traditional Name: 2-(4-amino-6-pyrrolidino-s-triazin-2-yl)-2-(4-dimethylaminophenyl)imino-acetonitrile Formula: C17H20N8 MolecularWeight: 336.3943

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)N=C(C#N)C2=NC(=NC(=N2)N)N3CCCC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)N=C(C#N)C2=NC(=NC(=N2)N)N3CCCC3

InChI

InChI=1S/C17H20N8/c1-24(2)13-7-5-12(6-8-13)20-14(11-18)15-21-16(19)23-17(22-15)25-9-3-4-10-25/h5-8H,3-4,9-10H2,1-2H3,(H2,19,21,22,23)