6-[[2-(aminocarbonylamino)-4-azanyl-3-methoxy-6-methyl-5-phenyldiazenyl-phenyl]diazenyl]naphthalene-2-sulfonic acid

Systemtic Name: 6-[[2-(aminocarbonylamino)-4-azanyl-3-methoxy-6-methyl-5-phenyldiazenyl-phenyl]diazenyl]naphthalene-2-sulfonic acid Openeye Name: 6-(4-amino-5-methoxy-2-methyl-3-phenylazo-6-ureido-phenyl)azonaphthalene-2-sulfonic acid CAS Name: 6-[4-amino-2-(carbamoylamino)-3-methoxy-6-methyl-5-phenyldiazenylphenyl]azo-2-naphthalenesulfonic acid IUPAC Name: 6-[[4-amino-2-(carbamoylamino)-3-methoxy-6-methyl-5-phenyldiazenylphenyl]diazenyl]naphthalene-2-sulfonic acid Traditional Name: 6-(4-amino-5-methoxy-2-methyl-3-phenylazo-6-ureido-phenyl)azonaphthalene-2-sulfonic acid Formula: C25H23N7O5S MolecularWeight: 533.55902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1N=NC2=CC3=C(C=C2)C=C(C=C3)S(=O)(=O)O)NC(=O)N)OC)N)N=NC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=C(C(=C1N=NC2=CC3=C(C=C2)C=C(C=C3)S(=O)(=O)O)NC(=O)N)OC)N)N=NC4=CC=CC=C4

InChI

InChI=1S/C25H23N7O5S/c1-14-21(31-29-17-6-4-3-5-7-17)20(26)24(37-2)23(28-25(27)33)22(14)32-30-18-10-8-16-13-19(38(34,35)36)11-9-15(16)12-18/h3-13H,26H2,1-2H3,(H3,27,28,33)(H,34,35,36)