[[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl]-methoxycarbonyl-amino]methyl cyclopentanecarboxylate

Systemtic Name: [[4-(1,3-benzothiazol-2-ylmethoxy)-2-methyl-phenyl]-methoxycarbonyl-amino]methyl cyclopentanecarboxylate Openeye Name: [4-(1,3-benzothiazol-2-ylmethoxy)-N-methoxycarbonyl-2-methyl-anilino]methyl cyclopentanecarboxylate CAS Name: cyclopentanecarboxylic acid [4-(1,3-benzothiazol-2-ylmethoxy)-N-methoxycarbonyl-2-methylanilino]methyl ester IUPAC Name: [4-(1,3-benzothiazol-2-ylmethoxy)-N-methoxycarbonyl-2-methylanilino]methyl cyclopentanecarboxylate Traditional Name: cyclopentanecarboxylic acid [4-(1,3-benzothiazol-2-ylmethoxy)-N-carbomethoxy-2-methyl-anilino]methyl ester Formula: C24H26N2O5S MolecularWeight: 454.53864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=NC3=CC=CC=C3S2)N(COC(=O)C4CCCC4)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=NC3=CC=CC=C3S2)N(COC(=O)C4CCCC4)C(=O)OC

InChI

InChI=1S/C24H26N2O5S/c1-16-13-18(30-14-22-25-19-9-5-6-10-21(19)32-22)11-12-20(16)26(24(28)29-2)15-31-23(27)17-7-3-4-8-17/h5-6,9-13,17H,3-4,7-8,14-15H2,1-2H3