6-chloranyl-N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2H-chromene-3-carboxamide

Systemtic Name: 6-chloranyl-N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2H-chromene-3-carboxamide Openeye Name: 6-chloro-N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2H-chromene-3-carboxamide CAS Name: 6-chloro-N-[5-[(4-cyanophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-2H-1-benzopyran-3-carboxamide IUPAC Name: 6-chloro-N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-2H-chromene-3-carboxamide Traditional Name: 6-chloro-N-[5-[(4-cyanobenzyl)thio]-1,3,4-thiadiazol-2-yl]-2H-chromene-3-carboxamide Formula: C20H13ClN4O2S2 MolecularWeight: 440.92582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=CC2=C(O1)C=CC(=C2)Cl)C(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)C#N

Isomeric SMILES

C1C(=CC2=C(O1)C=CC(=C2)Cl)C(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C20H13ClN4O2S2/c21-16-5-6-17-14(8-16)7-15(10-27-17)18(26)23-19-24-25-20(29-19)28-11-13-3-1-12(9-22)2-4-13/h1-8H,10-11H2,(H,23,24,26)