2-(pentyldisulfanyl)-5-(phenylmethyl)-1,3,4-thiadiazole

Systemtic Name: 2-(pentyldisulfanyl)-5-(phenylmethyl)-1,3,4-thiadiazole Openeye Name: 2-benzyl-5-(pentyldisulfanyl)-1,3,4-thiadiazole CAS Name: 2-(pentyldisulfanyl)-5-(phenylmethyl)-1,3,4-thiadiazole IUPAC Name: 2-benzyl-5-(pentyldisulfanyl)-1,3,4-thiadiazole Traditional Name: 2-(amyldisulfanyl)-5-benzyl-1,3,4-thiadiazole Formula: C14H18N2S3 MolecularWeight: 310.50112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSSC1=NN=C(S1)CC2=CC=CC=C2

Isomeric SMILES

CCCCCSSC1=NN=C(S1)CC2=CC=CC=C2

InChI

InChI=1S/C14H18N2S3/c1-2-3-7-10-17-19-14-16-15-13(18-14)11-12-8-5-4-6-9-12/h4-6,8-9H,2-3,7,10-11H2,1H3