3-azanyl-6-[[(3,4-dichlorophenyl)-propan-2-yl-amino]methyl]pyrazine-2-carbonitrile

Systemtic Name: 3-azanyl-6-[[(3,4-dichlorophenyl)-propan-2-yl-amino]methyl]pyrazine-2-carbonitrile Openeye Name: 3-amino-6-[(3,4-dichloro-N-isopropyl-anilino)methyl]pyrazine-2-carbonitrile CAS Name: 3-amino-6-[(3,4-dichloro-N-propan-2-ylanilino)methyl]-2-pyrazinecarbonitrile IUPAC Name: 3-amino-6-[(3,4-dichloro-N-propan-2-ylanilino)methyl]pyrazine-2-carbonitrile Traditional Name: 3-amino-6-[(3,4-dichloro-N-isopropyl-anilino)methyl]pyrazinonitrile Formula: C15H15Cl2N5 MolecularWeight: 336.2191

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CN=C(C(=N1)C#N)N)C2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C)N(CC1=CN=C(C(=N1)C#N)N)C2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C15H15Cl2N5/c1-9(2)22(11-3-4-12(16)13(17)5-11)8-10-7-20-15(19)14(6-18)21-10/h3-5,7,9H,8H2,1-2H3,(H2,19,20)