2-(3-chlorophenyl)-4-[(1H-1,2,4-triazol-5-ylamino)methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-(3-chlorophenyl)-4-[(1H-1,2,4-triazol-5-ylamino)methylidene]isoquinoline-1,3-dione Openeye Name: 2-(3-chlorophenyl)-4-[(1H-1,2,4-triazol-5-ylamino)methylene]isoquinoline-1,3-dione CAS Name: 2-(3-chlorophenyl)-4-[(1H-1,2,4-triazol-5-ylamino)methylidene]isoquinoline-1,3-dione IUPAC Name: 2-(3-chlorophenyl)-4-[(1H-1,2,4-triazol-5-ylamino)methylidene]isoquinoline-1,3-dione Traditional Name: 2-(3-chlorophenyl)-4-[(1H-1,2,4-triazol-5-ylamino)methylene]isoquinoline-1,3-quinone Formula: C18H12ClN5O2 MolecularWeight: 365.77318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CNC3=NC=NN3)C(=O)N(C2=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CNC3=NC=NN3)C(=O)N(C2=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C18H12ClN5O2/c19-11-4-3-5-12(8-11)24-16(25)14-7-2-1-6-13(14)15(17(24)26)9-20-18-21-10-22-23-18/h1-10H,(H2,20,21,22,23)