6-azanyl-5-[(4-methylphenyl)methyl]-7-(phenylsulfonyl)pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile

Systemtic Name: 6-azanyl-5-[(4-methylphenyl)methyl]-7-(phenylsulfonyl)pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile Openeye Name: 6-amino-7-(benzenesulfonyl)-5-(p-tolylmethyl)pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile CAS Name: 6-amino-7-(benzenesulfonyl)-5-[(4-methylphenyl)methyl]pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile IUPAC Name: 6-amino-7-(benzenesulfonyl)-5-[(4-methylphenyl)methyl]pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile Traditional Name: 6-amino-7-besyl-5-(4-methylbenzyl)pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile Formula: C22H16N6O2S MolecularWeight: 428.46644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C3=NC(=C(N=C32)C#N)C#N)S(=O)(=O)C4=CC=CC=C4)N

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C3=NC(=C(N=C32)C#N)C#N)S(=O)(=O)C4=CC=CC=C4)N

InChI

InChI=1S/C22H16N6O2S/c1-14-7-9-15(10-8-14)13-28-21(25)20(31(29,30)16-5-3-2-4-6-16)19-22(28)27-18(12-24)17(11-23)26-19/h2-10H,13,25H2,1H3