4-[[4-(3-azanylpropylamino)-6-[[2,6-bis(chloranyl)phenyl]methyl]-1,3,5-triazin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-(3-azanylpropylamino)-6-[[2,6-bis(chloranyl)phenyl]methyl]-1,3,5-triazin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-(3-aminopropylamino)-6-[(2,6-dichlorophenyl)methyl]-1,3,5-triazin-2-yl]amino]benzonitrile CAS Name: 4-[[4-(3-aminopropylamino)-6-[(2,6-dichlorophenyl)methyl]-1,3,5-triazin-2-yl]amino]benzonitrile IUPAC Name: 4-[[4-(3-aminopropylamino)-6-[(2,6-dichlorophenyl)methyl]-1,3,5-triazin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-(3-aminopropylamino)-6-(2,6-dichlorobenzyl)-s-triazin-2-yl]amino]benzonitrile Formula: C20H19Cl2N7 MolecularWeight: 428.31776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CC2=NC(=NC(=N2)NCCCN)NC3=CC=C(C=C3)C#N)Cl

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CC2=NC(=NC(=N2)NCCCN)NC3=CC=C(C=C3)C#N)Cl

InChI

InChI=1S/C20H19Cl2N7/c21-16-3-1-4-17(22)15(16)11-18-27-19(25-10-2-9-23)29-20(28-18)26-14-7-5-13(12-24)6-8-14/h1,3-8H,2,9-11,23H2,(H2,25,26,27,28,29)