[4-(5-chloranylthiophen-2-yl)-1-imidazol-1-yl-butan-2-yl] methanesulfonate

Systemtic Name: [4-(5-chloranylthiophen-2-yl)-1-imidazol-1-yl-butan-2-yl] methanesulfonate Openeye Name: [3-(5-chloro-2-thienyl)-1-(imidazol-1-ylmethyl)propyl] methanesulfonate CAS Name: methanesulfonic acid [4-(5-chloro-2-thiophenyl)-1-(1-imidazolyl)butan-2-yl] ester IUPAC Name: [4-(5-chlorothiophen-2-yl)-1-imidazol-1-ylbutan-2-yl] methanesulfonate Traditional Name: methanesulfonic acid [3-(5-chloro-2-thienyl)-1-(imidazol-1-ylmethyl)propyl] ester Formula: C12H15ClN2O3S2 MolecularWeight: 334.8421

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC(CCC1=CC=C(S1)Cl)CN2C=CN=C2

Isomeric SMILES

CS(=O)(=O)OC(CCC1=CC=C(S1)Cl)CN2C=CN=C2

InChI

InChI=1S/C12H15ClN2O3S2/c1-20(16,17)18-10(8-15-7-6-14-9-15)2-3-11-4-5-12(13)19-11/h4-7,9-10H,2-3,8H2,1H3