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2-(2,1,3-benzoxadiazol-5-ylmethylsulfanyl)ethyl 4-(2,4-dimethoxyphenyl)piperazine-1-carboxylate

2-(2,1,3-benzoxadiazol-5-ylmethylsulfanyl)ethyl 4-(2,4-dimethoxyphenyl)piperazine-1-carboxylate

Systemtic Name:2-(2,1,3-benzoxadiazol-5-ylmethylsulfanyl)ethyl 4-(2,4-dimethoxyphenyl)piperazine-1-carboxylate
Openeye Name:2-(2,1,3-benzoxadiazol-5-ylmethylsulfanyl)ethyl 4-(2,4-dimethoxyphenyl)piperazine-1-carboxylate
CAS Name:4-(2,4-dimethoxyphenyl)-1-piperazinecarboxylic acid 2-(2,1,3-benzoxadiazol-5-ylmethylthio)ethyl ester
IUPAC Name:2-(2,1,3-benzoxadiazol-5-ylmethylsulfanyl)ethyl 4-(2,4-dimethoxyphenyl)piperazine-1-carboxylate
Traditional Name:4-(2,4-dimethoxyphenyl)piperazine-1-carboxylic acid 2-(benzofurazan-5-ylmethylthio)ethyl ester
Formula: C22H26N4O5S
MolecularWeight: 458.53064
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2CCN(CC2)C(=O)OCCSCC3=CC4=NON=C4C=C3)OC


Isomeric SMILES

COC1=CC(=C(C=C1)N2CCN(CC2)C(=O)OCCSCC3=CC4=NON=C4C=C3)OC


InChI

InChI=1S/C22H26N4O5S/c1-28-17-4-6-20(21(14-17)29-2)25-7-9-26(10-8-25)22(27)30-11-12-32-15-16-3-5-18-19(13-16)24-31-23-18/h3-6,13-14H,7-12,15H2,1-2H3


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