5-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-(2-methoxyethyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-(2-methoxyethyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-(2-methoxyethyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-(1,3-benzothiazol-2-ylmethylthio)-N-(2-methoxyethyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-(2-methoxyethyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-(1,3-benzothiazol-2-ylmethylthio)-1,3,4-thiadiazol-2-yl]-(2-methoxyethyl)amine Formula: C13H14N4OS3 MolecularWeight: 338.47146

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=NN=C(S1)SCC2=NC3=CC=CC=C3S2

Isomeric SMILES

COCCNC1=NN=C(S1)SCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C13H14N4OS3/c1-18-7-6-14-12-16-17-13(21-12)19-8-11-15-9-4-2-3-5-10(9)20-11/h2-5H,6-8H2,1H3,(H,14,16)