3-[[5-[(4-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 3-[[5-[(4-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-[[5-[(4-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzonitrile CAS Name: 3-[[[5-[(4-methoxyphenyl)methylthio]-1,3,4-thiadiazol-2-yl]thio]methyl]benzonitrile IUPAC Name: 3-[[5-[(4-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 3-[[[5-(p-anisylthio)-1,3,4-thiadiazol-2-yl]thio]methyl]benzonitrile Formula: C18H15N3OS3 MolecularWeight: 385.5262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2=NN=C(S2)SCC3=CC=CC(=C3)C#N

Isomeric SMILES

COC1=CC=C(C=C1)CSC2=NN=C(S2)SCC3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H15N3OS3/c1-22-16-7-5-13(6-8-16)11-23-17-20-21-18(25-17)24-12-15-4-2-3-14(9-15)10-19/h2-9H,11-12H2,1H3