7-bromanyl-N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1-benzofuran-2-carboxamide

Systemtic Name: 7-bromanyl-N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1-benzofuran-2-carboxamide Openeye Name: 7-bromo-N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]benzofuran-2-carboxamide CAS Name: 7-bromo-N-[5-[(4-cyanophenyl)methylthio]-1,3,4-thiadiazol-2-yl]-2-benzofurancarboxamide IUPAC Name: 7-bromo-N-[5-[(4-cyanophenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1-benzofuran-2-carboxamide Traditional Name: 7-bromo-N-[5-[(4-cyanobenzyl)thio]-1,3,4-thiadiazol-2-yl]coumarilamide Formula: C19H11BrN4O2S2 MolecularWeight: 471.35024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Br)OC(=C2)C(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC2=C(C(=C1)Br)OC(=C2)C(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C19H11BrN4O2S2/c20-14-3-1-2-13-8-15(26-16(13)14)17(25)22-18-23-24-19(28-18)27-10-12-6-4-11(9-21)5-7-12/h1-8H,10H2,(H,22,23,25)