2-[[3-[5-(1-benzothiophen-2-ylcarbonylamino)pyridin-2-yl]-1-methoxy-1-oxidanylidene-propan-2-yl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[3-[5-(1-benzothiophen-2-ylcarbonylamino)pyridin-2-yl]-1-methoxy-1-oxidanylidene-propan-2-yl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[[1-[[5-(benzothiophene-2-carbonylamino)-2-pyridyl]methyl]-2-methoxy-2-oxo-ethyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[3-[5-[[1-benzothiophen-2-yl(oxo)methyl]amino]-2-pyridinyl]-1-methoxy-1-oxopropan-2-yl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[3-[5-(1-benzothiophene-2-carbonylamino)pyridin-2-yl]-1-methoxy-1-oxopropan-2-yl]amino]-4-methylpentanoic acid Traditional Name: 2-[[1-[[5-(benzothiophene-2-carbonylamino)-2-pyridyl]methyl]-2-keto-2-methoxy-ethyl]amino]-4-methyl-valeric acid Formula: C24H27N3O5S MolecularWeight: 469.55328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(CC1=NC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3S2)C(=O)OC

Isomeric SMILES

CC(C)CC(C(=O)O)NC(CC1=NC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3S2)C(=O)OC

InChI

InChI=1S/C24H27N3O5S/c1-14(2)10-18(23(29)30)27-19(24(31)32-3)12-16-8-9-17(13-25-16)26-22(28)21-11-15-6-4-5-7-20(15)33-21/h4-9,11,13-14,18-19,27H,10,12H2,1-3H3,(H,26,28)(H,29,30)