3-chloranyl-N-[3-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-4-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[3-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-4-yl]-1-benzothiophene-2-carboxamide Openeye Name: N-(3-benzylsulfanyl-5-methyl-1,2,4-triazol-4-yl)-3-chloro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[3-methyl-5-(phenylmethylthio)-1,2,4-triazol-4-yl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(3-benzylsulfanyl-5-methyl-1,2,4-triazol-4-yl)-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[3-(benzylthio)-5-methyl-1,2,4-triazol-4-yl]-3-chloro-benzothiophene-2-carboxamide Formula: C19H15ClN4OS2 MolecularWeight: 414.9316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1NC(=O)C2=C(C3=CC=CC=C3S2)Cl)SCC4=CC=CC=C4

Isomeric SMILES

CC1=NN=C(N1NC(=O)C2=C(C3=CC=CC=C3S2)Cl)SCC4=CC=CC=C4

InChI

InChI=1S/C19H15ClN4OS2/c1-12-21-22-19(26-11-13-7-3-2-4-8-13)24(12)23-18(25)17-16(20)14-9-5-6-10-15(14)27-17/h2-10H,11H2,1H3,(H,23,25)