sodium 2-[(5-methylthieno[2,3-d]pyrimidin-4-yl)amino]-2,3-dihydro-1H-indene-5-carboxylic acid

Systemtic Name: sodium 2-[(5-methylthieno[2,3-d]pyrimidin-4-yl)amino]-2,3-dihydro-1H-indene-5-carboxylic acid Openeye Name: sodium 2-[(5-methylthieno[2,3-d]pyrimidin-4-yl)amino]indane-5-carboxylic acid CAS Name: sodium 2-[(5-methyl-4-thieno[2,3-d]pyrimidinyl)amino]-2,3-dihydro-1H-indene-5-carboxylic acid IUPAC Name: sodium 2-[(5-methylthieno[2,3-d]pyrimidin-4-yl)amino]-2,3-dihydro-1H-indene-5-carboxylic acid Traditional Name: sodium 2-[(5-methylthieno[2,3-d]pyrimidin-4-yl)amino]indane-5-carboxylic acid Formula: C17H15N3NaO2S+ MolecularWeight: 348.37467

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=NC=NC(=C12)NC3CC4=C(C3)C=C(C=C4)C(=O)O.[Na+]

Isomeric SMILES

CC1=CSC2=NC=NC(=C12)NC3CC4=C(C3)C=C(C=C4)C(=O)O.[Na+]

InChI

InChI=1S/C17H15N3O2S.Na/c1-9-7-23-16-14(9)15(18-8-19-16)20-13-5-10-2-3-11(17(21)22)4-12(10)6-13;/h2-4,7-8,13H,5-6H2,1H3,(H,21,22)(H,18,19,20);/q;+1