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

Systemtic Name: N-[5-[(2-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: N-[5-(o-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]butanamide CAS Name: N-[5-[(2-methylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: N-[5-[(2-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]butanamide Traditional Name: N-[5-[(2-methylbenzyl)thio]-1,3,4-thiadiazol-2-yl]butyramide Formula: C14H17N3OS2 MolecularWeight: 307.43428

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=NN=C(S1)SCC2=CC=CC=C2C

Isomeric SMILES

CCCC(=O)NC1=NN=C(S1)SCC2=CC=CC=C2C

InChI

InChI=1S/C14H17N3OS2/c1-3-6-12(18)15-13-16-17-14(20-13)19-9-11-8-5-4-7-10(11)2/h4-5,7-8H,3,6,9H2,1-2H3,(H,15,16,18)