2-phenyl-4-[(1,2,4-triazol-4-ylamino)methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-phenyl-4-[(1,2,4-triazol-4-ylamino)methylidene]isoquinoline-1,3-dione Openeye Name: 2-phenyl-4-[(1,2,4-triazol-4-ylamino)methylene]isoquinoline-1,3-dione CAS Name: 2-phenyl-4-[(1,2,4-triazol-4-ylamino)methylidene]isoquinoline-1,3-dione IUPAC Name: 2-phenyl-4-[(1,2,4-triazol-4-ylamino)methylidene]isoquinoline-1,3-dione Traditional Name: 2-phenyl-4-[(1,2,4-triazol-4-ylamino)methylene]isoquinoline-1,3-quinone Formula: C18H13N5O2 MolecularWeight: 331.32812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNN4C=NN=C4)C2=O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNN4C=NN=C4)C2=O

InChI

InChI=1S/C18H13N5O2/c24-17-15-9-5-4-8-14(15)16(10-21-22-11-19-20-12-22)18(25)23(17)13-6-2-1-3-7-13/h1-12,21H