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

Systemtic Name: [1-imidazol-1-yl-4-(5-methylthiophen-2-yl)butan-2-yl] methanesulfonate Openeye Name: [1-(imidazol-1-ylmethyl)-3-(5-methyl-2-thienyl)propyl] methanesulfonate CAS Name: methanesulfonic acid [1-(1-imidazolyl)-4-(5-methyl-2-thiophenyl)butan-2-yl] ester IUPAC Name: [1-imidazol-1-yl-4-(5-methylthiophen-2-yl)butan-2-yl] methanesulfonate Traditional Name: methanesulfonic acid [1-(imidazol-1-ylmethyl)-3-(5-methyl-2-thienyl)propyl] ester Formula: C13H18N2O3S2 MolecularWeight: 314.42362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CCC(CN2C=CN=C2)OS(=O)(=O)C

Isomeric SMILES

CC1=CC=C(S1)CCC(CN2C=CN=C2)OS(=O)(=O)C

InChI

InChI=1S/C13H18N2O3S2/c1-11-3-5-13(19-11)6-4-12(18-20(2,16)17)9-15-8-7-14-10-15/h3,5,7-8,10,12H,4,6,9H2,1-2H3