3-[4-(cyclopentylmethoxy)-3-(3-methyl-2-methylimino-1,3-benzothiazol-6-yl)phenyl]propanoic acid

Systemtic Name: 3-[4-(cyclopentylmethoxy)-3-(3-methyl-2-methylimino-1,3-benzothiazol-6-yl)phenyl]propanoic acid Openeye Name: 3-[4-(cyclopentylmethoxy)-3-(3-methyl-2-methylimino-1,3-benzothiazol-6-yl)phenyl]propanoic acid CAS Name: 3-[4-(cyclopentylmethoxy)-3-(3-methyl-2-methylimino-1,3-benzothiazol-6-yl)phenyl]propanoic acid IUPAC Name: 3-[4-(cyclopentylmethoxy)-3-(3-methyl-2-methylimino-1,3-benzothiazol-6-yl)phenyl]propanoic acid Traditional Name: 3-[4-(cyclopentylmethoxy)-3-(3-methyl-2-methylimino-1,3-benzothiazol-6-yl)phenyl]propionic acid Formula: C24H28N2O3S MolecularWeight: 424.55572

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Descriptors Computed from Structure

Canonical SMILES:

CN=C1N(C2=C(S1)C=C(C=C2)C3=C(C=CC(=C3)CCC(=O)O)OCC4CCCC4)C

Isomeric SMILES

CN=C1N(C2=C(S1)C=C(C=C2)C3=C(C=CC(=C3)CCC(=O)O)OCC4CCCC4)C

InChI

InChI=1S/C24H28N2O3S/c1-25-24-26(2)20-10-9-18(14-22(20)30-24)19-13-16(8-12-23(27)28)7-11-21(19)29-15-17-5-3-4-6-17/h7,9-11,13-14,17H,3-6,8,12,15H2,1-2H3,(H,27,28)