3-[[4-[bis(2-cyanoethyl)amino]-6-phenyl-1,3,5-triazin-2-yl]-(2-cyanoethyl)amino]propanenitrile

Systemtic Name: 3-[[4-[bis(2-cyanoethyl)amino]-6-phenyl-1,3,5-triazin-2-yl]-(2-cyanoethyl)amino]propanenitrile Openeye Name: 3-[[4-[bis(2-cyanoethyl)amino]-6-phenyl-1,3,5-triazin-2-yl]-(2-cyanoethyl)amino]propanenitrile CAS Name: 3-[[4-[bis(2-cyanoethyl)amino]-6-phenyl-1,3,5-triazin-2-yl]-(2-cyanoethyl)amino]propanenitrile IUPAC Name: 3-[[4-[bis(2-cyanoethyl)amino]-6-phenyl-1,3,5-triazin-2-yl]-(2-cyanoethyl)amino]propanenitrile Traditional Name: 3-[[4-[bis(2-cyanoethyl)amino]-6-phenyl-s-triazin-2-yl]-(2-cyanoethyl)amino]propionitrile Formula: C21H21N9 MolecularWeight: 399.45174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC(=N2)N(CCC#N)CCC#N)N(CCC#N)CCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC(=N2)N(CCC#N)CCC#N)N(CCC#N)CCC#N

InChI

InChI=1S/C21H21N9/c22-10-4-14-29(15-5-11-23)20-26-19(18-8-2-1-3-9-18)27-21(28-20)30(16-6-12-24)17-7-13-25/h1-3,8-9H,4-7,14-17H2