6-azanyl-7-(1,3-benzothiazol-2-yl)-5-(2-methylphenyl)pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile

Systemtic Name: 6-azanyl-7-(1,3-benzothiazol-2-yl)-5-(2-methylphenyl)pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile Openeye Name: 6-amino-7-(1,3-benzothiazol-2-yl)-5-(o-tolyl)pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile CAS Name: 6-amino-7-(1,3-benzothiazol-2-yl)-5-(2-methylphenyl)pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile IUPAC Name: 6-amino-7-(1,3-benzothiazol-2-yl)-5-(2-methylphenyl)pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile Traditional Name: 6-amino-7-(1,3-benzothiazol-2-yl)-5-(o-tolyl)pyrrolo[2,3-b]pyrazine-2,3-dicarbonitrile Formula: C22H13N7S MolecularWeight: 407.45052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C3=NC(=C(N=C32)C#N)C#N)C4=NC5=CC=CC=C5S4)N

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C3=NC(=C(N=C32)C#N)C#N)C4=NC5=CC=CC=C5S4)N

InChI

InChI=1S/C22H13N7S/c1-12-6-2-4-8-16(12)29-20(25)18(22-28-13-7-3-5-9-17(13)30-22)19-21(29)27-15(11-24)14(10-23)26-19/h2-9H,25H2,1H3