phenyl 2-[(2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl)sulfanyl]ethanesulfonate

Systemtic Name: phenyl 2-[(2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl)sulfanyl]ethanesulfonate Openeye Name: phenyl 2-[(2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl)sulfanyl]ethanesulfonate CAS Name: 2-[[2-(3-indolylidene)-3H-1,3,4-oxadiazol-5-yl]thio]ethanesulfonic acid phenyl ester IUPAC Name: phenyl 2-[(2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl)sulfanyl]ethanesulfonate Traditional Name: 2-[(2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl)thio]ethanesulfonic acid phenyl ester Formula: C18H15N3O4S2 MolecularWeight: 401.4594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OS(=O)(=O)CCSC2=NNC(=C3C=NC4=CC=CC=C43)O2

Isomeric SMILES

C1=CC=C(C=C1)OS(=O)(=O)CCSC2=NNC(=C3C=NC4=CC=CC=C43)O2

InChI

InChI=1S/C18H15N3O4S2/c22-27(23,25-13-6-2-1-3-7-13)11-10-26-18-21-20-17(24-18)15-12-19-16-9-5-4-8-14(15)16/h1-9,12,20H,10-11H2