2-[[5-[(4-propan-2-ylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1,3-benzoxazole

Systemtic Name: 2-[[5-[(4-propan-2-ylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1,3-benzoxazole Openeye Name: 2-[[5-[(4-isopropylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1,3-benzoxazole CAS Name: 2-[[[5-[(4-propan-2-ylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]thio]methyl]-1,3-benzoxazole IUPAC Name: 2-[[5-[(4-propan-2-ylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]-1,3-benzoxazole Traditional Name: 2-[[[5-[(4-isopropylbenzyl)thio]-1,3,4-thiadiazol-2-yl]thio]methyl]-1,3-benzoxazole Formula: C20H19N3OS3 MolecularWeight: 413.57936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CSC2=NN=C(S2)SCC3=NC4=CC=CC=C4O3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CSC2=NN=C(S2)SCC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C20H19N3OS3/c1-13(2)15-9-7-14(8-10-15)11-25-19-22-23-20(27-19)26-12-18-21-16-5-3-4-6-17(16)24-18/h3-10,13H,11-12H2,1-2H3