3-chloranyl-6-methyl-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-6-methyl-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-6-methyl-N-[5-(p-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzothiophene-2-carboxamide CAS Name: 3-chloro-6-methyl-N-[5-[(4-methylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-6-methyl-N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-6-methyl-N-[5-[(4-methylbenzyl)thio]-1,3,4-thiadiazol-2-yl]benzothiophene-2-carboxamide Formula: C20H16ClN3OS3 MolecularWeight: 446.00854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)C)Cl

InChI

InChI=1S/C20H16ClN3OS3/c1-11-3-6-13(7-4-11)10-26-20-24-23-19(28-20)22-18(25)17-16(21)14-8-5-12(2)9-15(14)27-17/h3-9H,10H2,1-2H3,(H,22,23,25)