2-[[4,6-bis(phenylazanyl)-1,3,5-triazin-2-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[4,6-bis(phenylazanyl)-1,3,5-triazin-2-yl]sulfanyl]ethanoic acid Openeye Name: 2-[(4,6-dianilino-1,3,5-triazin-2-yl)sulfanyl]acetic acid CAS Name: 2-[(4,6-dianilino-1,3,5-triazin-2-yl)thio]acetic acid IUPAC Name: 2-[(4,6-dianilino-1,3,5-triazin-2-yl)sulfanyl]acetic acid Traditional Name: 2-[(4,6-dianilino-s-triazin-2-yl)thio]acetic acid Formula: C17H15N5O2S MolecularWeight: 353.3983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)SCC(=O)O)NC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)SCC(=O)O)NC3=CC=CC=C3

InChI

InChI=1S/C17H15N5O2S/c23-14(24)11-25-17-21-15(18-12-7-3-1-4-8-12)20-16(22-17)19-13-9-5-2-6-10-13/h1-10H,11H2,(H,23,24)(H2,18,19,20,21,22)