2-[4-azanyl-6-[4-(3-chlorophenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]ethanenitrile

Systemtic Name: 2-[4-azanyl-6-[4-(3-chlorophenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]ethanenitrile Openeye Name: 2-[4-amino-6-[4-(3-chlorophenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]acetonitrile CAS Name: 2-[4-amino-6-[4-(3-chlorophenyl)-1-piperazinyl]-1,3,5-triazin-2-yl]acetonitrile IUPAC Name: 2-[4-amino-6-[4-(3-chlorophenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]acetonitrile Traditional Name: 2-[4-amino-6-[4-(3-chlorophenyl)piperazino]-s-triazin-2-yl]acetonitrile Formula: C15H16ClN7 MolecularWeight: 329.78744

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=NC(=NC(=N3)CC#N)N

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=NC(=NC(=N3)CC#N)N

InChI

InChI=1S/C15H16ClN7/c16-11-2-1-3-12(10-11)22-6-8-23(9-7-22)15-20-13(4-5-17)19-14(18)21-15/h1-3,10H,4,6-9H2,(H2,18,19,20,21)