butyl 4-[2-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanyl]ethanoylamino]benzoate

Systemtic Name: butyl 4-[2-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanyl]ethanoylamino]benzoate Openeye Name: butyl 4-[[2-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanyl]acetyl]amino]benzoate CAS Name: 4-[[2-[[(2E)-2-(3-indolylidene)-3H-1,3,4-oxadiazol-5-yl]thio]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]sulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[[(2E)-2-indol-3-ylidene-3H-1,3,4-oxadiazol-5-yl]thio]acetyl]amino]benzoic acid butyl ester Formula: C23H22N4O4S MolecularWeight: 450.51018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NNC(=C3C=NC4=CC=CC=C43)O2

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN/C(=C/3\C=NC4=CC=CC=C43)/O2

InChI

InChI=1S/C23H22N4O4S/c1-2-3-12-30-22(29)15-8-10-16(11-9-15)25-20(28)14-32-23-27-26-21(31-23)18-13-24-19-7-5-4-6-17(18)19/h4-11,13,26H,2-3,12,14H2,1H3,(H,25,28)/b21-18-