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

Systemtic Name: N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1,3-benzothiazole-6-carboxamide Openeye Name: N-[5-(p-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-1,3-benzothiazole-6-carboxamide CAS Name: N-[5-[(4-methylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[5-[(4-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]-1,3-benzothiazole-6-carboxamide Traditional Name: N-[5-[(4-methylbenzyl)thio]-1,3,4-thiadiazol-2-yl]-1,3-benzothiazole-6-carboxamide Formula: C18H14N4OS3 MolecularWeight: 398.52496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=CC4=C(C=C3)N=CS4

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C18H14N4OS3/c1-11-2-4-12(5-3-11)9-24-18-22-21-17(26-18)20-16(23)13-6-7-14-15(8-13)25-10-19-14/h2-8,10H,9H2,1H3,(H,20,21,23)