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

Systemtic Name: 3-chloranyl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-chloro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-3-chloro-benzothiophene-2-carboxamide Formula: C18H12ClN3OS3 MolecularWeight: 417.95538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C18H12ClN3OS3/c19-14-12-8-4-5-9-13(12)25-15(14)16(23)20-17-21-22-18(26-17)24-10-11-6-2-1-3-7-11/h1-9H,10H2,(H,20,21,23)