2-azanyl-4,5-bis[(2-hydroxyethylamino)-phenyl-amino]-3-(1,3,5-triazin-2-yl)benzenesulfonic acid

Systemtic Name: 2-azanyl-4,5-bis[(2-hydroxyethylamino)-phenyl-amino]-3-(1,3,5-triazin-2-yl)benzenesulfonic acid Openeye Name: 2-amino-4,5-bis(N-(2-hydroxyethylamino)anilino)-3-(1,3,5-triazin-2-yl)benzenesulfonic acid CAS Name: 2-amino-4,5-bis(N-(2-hydroxyethylamino)anilino)-3-(1,3,5-triazin-2-yl)benzenesulfonic acid IUPAC Name: 2-amino-4,5-bis(N-(2-hydroxyethylamino)anilino)-3-(1,3,5-triazin-2-yl)benzenesulfonic acid Traditional Name: 2-amino-4,5-bis(N-(2-hydroxyethylamino)anilino)-3-(s-triazin-2-yl)besylic acid Formula: C25H28N8O5S MolecularWeight: 552.60542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(C2=CC(=C(C(=C2N(C3=CC=CC=C3)NCCO)C4=NC=NC=N4)N)S(=O)(=O)O)NCCO

Isomeric SMILES

C1=CC=C(C=C1)N(C2=CC(=C(C(=C2N(C3=CC=CC=C3)NCCO)C4=NC=NC=N4)N)S(=O)(=O)O)NCCO

InChI

InChI=1S/C25H28N8O5S/c26-23-21(39(36,37)38)15-20(32(30-11-13-34)18-7-3-1-4-8-18)24(22(23)25-28-16-27-17-29-25)33(31-12-14-35)19-9-5-2-6-10-19/h1-10,15-17,30-31,34-35H,11-14,26H2,(H,36,37,38)