N-(4-chlorophenyl)-5-(3,5-dimethoxy-2-pyridin-4-yl-phenyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(4-chlorophenyl)-5-(3,5-dimethoxy-2-pyridin-4-yl-phenyl)-1,3,4-thiadiazol-2-amine Openeye Name: N-(4-chlorophenyl)-5-[3,5-dimethoxy-2-(4-pyridyl)phenyl]-1,3,4-thiadiazol-2-amine CAS Name: N-(4-chlorophenyl)-5-(3,5-dimethoxy-2-pyridin-4-ylphenyl)-1,3,4-thiadiazol-2-amine IUPAC Name: N-(4-chlorophenyl)-5-(3,5-dimethoxy-2-pyridin-4-ylphenyl)-1,3,4-thiadiazol-2-amine Traditional Name: (4-chlorophenyl)-[5-[3,5-dimethoxy-2-(4-pyridyl)phenyl]-1,3,4-thiadiazol-2-yl]amine Formula: C21H17ClN4O2S MolecularWeight: 424.90328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)C2=NN=C(S2)NC3=CC=C(C=C3)Cl)C4=CC=NC=C4)OC

Isomeric SMILES

COC1=CC(=C(C(=C1)C2=NN=C(S2)NC3=CC=C(C=C3)Cl)C4=CC=NC=C4)OC

InChI

InChI=1S/C21H17ClN4O2S/c1-27-16-11-17(19(18(12-16)28-2)13-7-9-23-10-8-13)20-25-26-21(29-20)24-15-5-3-14(22)4-6-15/h3-12H,1-2H3,(H,24,26)