2-[[1-[2-(1,3-benzothiazol-2-yl)ethoxy]naphthalen-2-yl]carbonylamino]-2-methyl-propanoic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2C=C1)OCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C)(C(=O)O)NC(=O)C1=C(C2=CC=CC=C2C=C1)OCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H22N2O4S/c1-24(2,23(28)29)26-22(27)17-12-11-15-7-3-4-8-16(15)21(17)30-14-13-20-25-18-9-5-6-10-19(18)31-20/h3-12H,13-14H2,1-2H3,(H,26,27)(H,28,29)