4-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)sulfanyl]ethoxy]benzoic acid

Systemtic Name: 4-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)sulfanyl]ethoxy]benzoic acid Openeye Name: 4-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)sulfanyl]ethoxy]benzoic acid CAS Name: 4-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)thio]ethoxy]benzoic acid IUPAC Name: 4-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)sulfanyl]ethoxy]benzoic acid Traditional Name: 4-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)thio]ethoxy]benzoic acid Formula: C14H15N3O3S MolecularWeight: 305.3522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NC(=N1)SCCOC2=CC=C(C=C2)C(=O)O)C

Isomeric SMILES

CC1=C(N=NC(=N1)SCCOC2=CC=C(C=C2)C(=O)O)C

InChI

InChI=1S/C14H15N3O3S/c1-9-10(2)16-17-14(15-9)21-8-7-20-12-5-3-11(4-6-12)13(18)19/h3-6H,7-8H2,1-2H3,(H,18,19)