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

Systemtic Name: 6-azanyl-5-phenethyl-7-(phenylsulfonyl)pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile Openeye Name: 6-amino-7-(benzenesulfonyl)-5-phenethyl-pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile CAS Name: 6-amino-7-(benzenesulfonyl)-5-phenethylpyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile IUPAC Name: 6-amino-7-(benzenesulfonyl)-5-phenethylpyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile Traditional Name: 6-amino-7-besyl-5-phenethyl-pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile Formula: C22H16N6O2S MolecularWeight: 428.46644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=C(C3=NC(=C(N=C32)C#N)C#N)S(=O)(=O)C4=CC=CC=C4)N

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=C(C3=NC(=C(N=C32)C#N)C#N)S(=O)(=O)C4=CC=CC=C4)N

InChI

InChI=1S/C22H16N6O2S/c23-13-17-18(14-24)27-22-19(26-17)20(31(29,30)16-9-5-2-6-10-16)21(25)28(22)12-11-15-7-3-1-4-8-15/h1-10H,11-12,25H2