5-methyl-4-[(5-oxidanylnaphthalen-1-yl)amino]thieno[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 5-methyl-4-[(5-oxidanylnaphthalen-1-yl)amino]thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 4-[(5-hydroxy-1-naphthyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 4-[(5-hydroxy-1-naphthalenyl)amino]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 4-[(5-hydroxynaphthalen-1-yl)amino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-[(5-hydroxy-1-naphthyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C18H13N3O3S MolecularWeight: 351.37912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC3=CC=CC4=C3C=CC=C4O)C(=O)O

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC3=CC=CC4=C3C=CC=C4O)C(=O)O

InChI

InChI=1S/C18H13N3O3S/c1-9-14-16(19-8-20-17(14)25-15(9)18(23)24)21-12-6-2-5-11-10(12)4-3-7-13(11)22/h2-8,22H,1H3,(H,23,24)(H,19,20,21)