4-(aziridin-1-yl)-6-[(4-chlorophenyl)amino]-1,3,5-triazine-2-carbonitrile

Systemtic Name: 4-(aziridin-1-yl)-6-[(4-chlorophenyl)amino]-1,3,5-triazine-2-carbonitrile Openeye Name: 4-(aziridin-1-yl)-6-(4-chloroanilino)-1,3,5-triazine-2-carbonitrile CAS Name: 4-(1-aziridinyl)-6-(4-chloroanilino)-1,3,5-triazine-2-carbonitrile IUPAC Name: 4-(aziridin-1-yl)-6-(4-chloroanilino)-1,3,5-triazine-2-carbonitrile Traditional Name: 4-(4-chloroanilino)-6-ethylenimino-s-triazine-2-carbonitrile Formula: C12H9ClN6 MolecularWeight: 272.69306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN1C2=NC(=NC(=N2)C#N)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN1C2=NC(=NC(=N2)C#N)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C12H9ClN6/c13-8-1-3-9(4-2-8)15-11-16-10(7-14)17-12(18-11)19-5-6-19/h1-4H,5-6H2,(H,15,16,17,18)