(3E)-2-azanyl-7-azanylidene-3-(1,3-benzodioxol-5-ylhydrazinylidene)pyrazolo[1,5-a]pyrimidine-6-carbonitrile

Systemtic Name: (3E)-2-azanyl-7-azanylidene-3-(1,3-benzodioxol-5-ylhydrazinylidene)pyrazolo[1,5-a]pyrimidine-6-carbonitrile Openeye Name: (3E)-2-amino-3-(1,3-benzodioxol-5-ylhydrazono)-7-imino-pyrazolo[1,5-a]pyrimidine-6-carbonitrile CAS Name: (3E)-2-amino-3-(1,3-benzodioxol-5-ylhydrazinylidene)-7-imino-6-pyrazolo[1,5-a]pyrimidinecarbonitrile IUPAC Name: (3E)-2-amino-3-(1,3-benzodioxol-5-ylhydrazinylidene)-7-iminopyrazolo[1,5-a]pyrimidine-6-carbonitrile Traditional Name: (3E)-2-amino-3-(1,3-benzodioxol-5-ylhydrazono)-7-imino-pyrazolo[1,5-a]pyrimidine-6-carbonitrile Formula: C14H10N8O2 MolecularWeight: 322.2816

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NN=C3C(=NN4C3=NC=C(C4=N)C#N)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)N/N=C/3\C(=NN4C3=NC=C(C4=N)C#N)N

InChI

InChI=1S/C14H10N8O2/c15-4-7-5-18-14-11(12(16)21-22(14)13(7)17)20-19-8-1-2-9-10(3-8)24-6-23-9/h1-3,5,17,19H,6H2,(H2,16,21)/b17-13?,20-11+