(5-phenyl-1,3,4-oxadiazol-2-yl)methyl-propan-2-yl-[(2-sulfanylidene-1,3-benzoxazol-3-yl)methyl]azanium

Systemtic Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl-propan-2-yl-[(2-sulfanylidene-1,3-benzoxazol-3-yl)methyl]azanium Openeye Name: isopropyl-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-[(2-thioxo-1,3-benzoxazol-3-yl)methyl]ammonium CAS Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl-propan-2-yl-[(2-sulfanylidene-1,3-benzoxazol-3-yl)methyl]ammonium IUPAC Name: (5-phenyl-1,3,4-oxadiazol-2-yl)methyl-propan-2-yl-[(2-sulfanylidene-1,3-benzoxazol-3-yl)methyl]azanium Traditional Name: isopropyl-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-[(2-thioxo-1,3-benzoxazol-3-yl)methyl]ammonium Formula: C20H21N4O2S+ MolecularWeight: 381.47134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CC1=NN=C(O1)C2=CC=CC=C2)CN3C4=CC=CC=C4OC3=S

Isomeric SMILES

CC(C)[NH+](CC1=NN=C(O1)C2=CC=CC=C2)CN3C4=CC=CC=C4OC3=S

InChI

InChI=1S/C20H20N4O2S/c1-14(2)23(13-24-16-10-6-7-11-17(16)25-20(24)27)12-18-21-22-19(26-18)15-8-4-3-5-9-15/h3-11,14H,12-13H2,1-2H3/p+1