N-butyl-5-[(2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: N-butyl-5-[(2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: N-butyl-5-[(2-phenyloxazol-4-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-butyl-5-[(2-phenyl-4-oxazolyl)methylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-butyl-5-[(2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: butyl-[5-[(2-phenyloxazol-4-yl)methylthio]-1,3,4-thiadiazol-2-yl]amine Formula: C16H18N4OS2 MolecularWeight: 346.47032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NN=C(S1)SCC2=COC(=N2)C3=CC=CC=C3

Isomeric SMILES

CCCCNC1=NN=C(S1)SCC2=COC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C16H18N4OS2/c1-2-3-9-17-15-19-20-16(23-15)22-11-13-10-21-14(18-13)12-7-5-4-6-8-12/h4-8,10H,2-3,9,11H2,1H3,(H,17,19)