2-[6-methoxy-2-[(2-methyl-2,3-dihydro-1-benzothiophen-7-yl)sulfonylcarbamoylamino]pyrimidin-4-yl]ethanoic acid

Systemtic Name: 2-[6-methoxy-2-[(2-methyl-2,3-dihydro-1-benzothiophen-7-yl)sulfonylcarbamoylamino]pyrimidin-4-yl]ethanoic acid Openeye Name: 2-[6-methoxy-2-[(2-methyl-2,3-dihydrobenzothiophen-7-yl)sulfonylcarbamoylamino]pyrimidin-4-yl]acetic acid CAS Name: 2-[6-methoxy-2-[[[(2-methyl-2,3-dihydro-1-benzothiophen-7-yl)sulfonylamino]-oxomethyl]amino]-4-pyrimidinyl]acetic acid IUPAC Name: 2-[6-methoxy-2-[(2-methyl-2,3-dihydro-1-benzothiophen-7-yl)sulfonylcarbamoylamino]pyrimidin-4-yl]acetic acid Traditional Name: 2-[6-methoxy-2-[(2-methyl-2,3-dihydrobenzothiophen-7-yl)sulfonylcarbamoylamino]pyrimidin-4-yl]acetic acid Formula: C17H18N4O6S2 MolecularWeight: 438.47802

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(S1)C(=CC=C2)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)CC(=O)O

Isomeric SMILES

CC1CC2=C(S1)C(=CC=C2)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)CC(=O)O

InChI

InChI=1S/C17H18N4O6S2/c1-9-6-10-4-3-5-12(15(10)28-9)29(25,26)21-17(24)20-16-18-11(8-14(22)23)7-13(19-16)27-2/h3-5,7,9H,6,8H2,1-2H3,(H,22,23)(H2,18,19,20,21,24)