2-[[1-(1,3-benzothiazol-2-ylmethoxy)naphthalen-2-yl]carbonylamino]-2-methyl-butanoic acid

Systemtic Name: 2-[[1-(1,3-benzothiazol-2-ylmethoxy)naphthalen-2-yl]carbonylamino]-2-methyl-butanoic acid Openeye Name: 2-[[1-(1,3-benzothiazol-2-ylmethoxy)naphthalene-2-carbonyl]amino]-2-methyl-butanoic acid CAS Name: 2-[[[1-(1,3-benzothiazol-2-ylmethoxy)-2-naphthalenyl]-oxomethyl]amino]-2-methylbutanoic acid IUPAC Name: 2-[[1-(1,3-benzothiazol-2-ylmethoxy)naphthalene-2-carbonyl]amino]-2-methylbutanoic acid Traditional Name: 2-[[1-(1,3-benzothiazol-2-ylmethoxy)-2-naphthoyl]amino]-2-methyl-butyric acid Formula: C24H22N2O4S MolecularWeight: 434.50748

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2C=C1)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCC(C)(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2C=C1)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H22N2O4S/c1-3-24(2,23(28)29)26-22(27)17-13-12-15-8-4-5-9-16(15)21(17)30-14-20-25-18-10-6-7-11-19(18)31-20/h4-13H,3,14H2,1-2H3,(H,26,27)(H,28,29)