N-[5-(7-chloranylquinolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-yl]-2-phenoxy-pyridine-3-carboxamide

Systemtic Name: N-[5-(7-chloranylquinolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-yl]-2-phenoxy-pyridine-3-carboxamide Openeye Name: N-[5-[(7-chloro-4-quinolyl)sulfanyl]-1,3,4-thiadiazol-2-yl]-2-phenoxy-pyridine-3-carboxamide CAS Name: N-[5-[(7-chloro-4-quinolinyl)thio]-1,3,4-thiadiazol-2-yl]-2-phenoxy-3-pyridinecarboxamide IUPAC Name: N-[5-(7-chloroquinolin-4-yl)sulfanyl-1,3,4-thiadiazol-2-yl]-2-phenoxypyridine-3-carboxamide Traditional Name: N-[5-[(7-chloro-4-quinolyl)thio]-1,3,4-thiadiazol-2-yl]-2-phenoxy-nicotinamide Formula: C23H14ClN5O2S2 MolecularWeight: 491.97256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C=CC=N2)C(=O)NC3=NN=C(S3)SC4=C5C=CC(=CC5=NC=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C=CC=N2)C(=O)NC3=NN=C(S3)SC4=C5C=CC(=CC5=NC=C4)Cl

InChI

InChI=1S/C23H14ClN5O2S2/c24-14-8-9-16-18(13-14)25-12-10-19(16)32-23-29-28-22(33-23)27-20(30)17-7-4-11-26-21(17)31-15-5-2-1-3-6-15/h1-13H,(H,27,28,30)