(4E)-2-pyridin-2-yl-4-[(1,3,4-thiadiazol-2-ylamino)methylidene]isoquinoline-1,3-dione

Systemtic Name: (4E)-2-pyridin-2-yl-4-[(1,3,4-thiadiazol-2-ylamino)methylidene]isoquinoline-1,3-dione Openeye Name: (4E)-2-(2-pyridyl)-4-[(1,3,4-thiadiazol-2-ylamino)methylene]isoquinoline-1,3-dione CAS Name: (4E)-2-(2-pyridinyl)-4-[(1,3,4-thiadiazol-2-ylamino)methylidene]isoquinoline-1,3-dione IUPAC Name: (4E)-2-pyridin-2-yl-4-[(1,3,4-thiadiazol-2-ylamino)methylidene]isoquinoline-1,3-dione Traditional Name: (4E)-2-(2-pyridyl)-4-[(1,3,4-thiadiazol-2-ylamino)methylene]isoquinoline-1,3-quinone Formula: C17H11N5O2S MolecularWeight: 349.36654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CNC3=NN=CS3)C(=O)N(C2=O)C4=CC=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)/C(=C\NC3=NN=CS3)/C(=O)N(C2=O)C4=CC=CC=N4

InChI

InChI=1S/C17H11N5O2S/c23-15-12-6-2-1-5-11(12)13(9-19-17-21-20-10-25-17)16(24)22(15)14-7-3-4-8-18-14/h1-10H,(H,19,21)/b13-9+