methyl [4,6-bis[(4-phenyldiazenylphenyl)amino]-1,3,5-triazin-2-yl]methanesulfonate

Systemtic Name: methyl [4,6-bis[(4-phenyldiazenylphenyl)amino]-1,3,5-triazin-2-yl]methanesulfonate Openeye Name: methyl [4,6-bis(4-phenylazoanilino)-1,3,5-triazin-2-yl]methanesulfonate CAS Name: [4,6-bis(4-phenyldiazenylanilino)-1,3,5-triazin-2-yl]methanesulfonic acid methyl ester IUPAC Name: methyl [4,6-bis(4-phenyldiazenylanilino)-1,3,5-triazin-2-yl]methanesulfonate Traditional Name: [4,6-bis(4-phenylazoanilino)-s-triazin-2-yl]methanesulfonic acid methyl ester Formula: C29H25N9O3S MolecularWeight: 579.6323

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Descriptors Computed from Structure

Canonical SMILES:

COS(=O)(=O)CC1=NC(=NC(=N1)NC2=CC=C(C=C2)N=NC3=CC=CC=C3)NC4=CC=C(C=C4)N=NC5=CC=CC=C5

Isomeric SMILES

COS(=O)(=O)CC1=NC(=NC(=N1)NC2=CC=C(C=C2)N=NC3=CC=CC=C3)NC4=CC=C(C=C4)N=NC5=CC=CC=C5

InChI

InChI=1S/C29H25N9O3S/c1-41-42(39,40)20-27-32-28(30-21-12-16-25(17-13-21)37-35-23-8-4-2-5-9-23)34-29(33-27)31-22-14-18-26(19-15-22)38-36-24-10-6-3-7-11-24/h2-19H,20H2,1H3,(H2,30,31,32,33,34)