4-azanyl-6-[(2Z)-2-[6-[(4-chloranyl-6-methyl-1,3,5-triazin-2-yl)amino]-2-oxidanylidene-4-sulfo-naphthalen-1-ylidene]hydrazinyl]-5-oxidanyl-3-[tris(oxidanyl)-$l^{4}-sulfanyl]naphthalene-1-sulfonic acid

Systemtic Name: 4-azanyl-6-[(2Z)-2-[6-[(4-chloranyl-6-methyl-1,3,5-triazin-2-yl)amino]-2-oxidanylidene-4-sulfo-naphthalen-1-ylidene]hydrazinyl]-5-oxidanyl-3-[tris(oxidanyl)-$l^{4}-sulfanyl]naphthalene-1-sulfonic acid Openeye Name: 4-amino-6-[(2Z)-2-[6-[(4-chloro-6-methyl-1,3,5-triazin-2-yl)amino]-2-oxo-4-sulfo-1-naphthylidene]hydrazino]-5-hydroxy-3-(trihydroxy-$l^{4}-sulfanyl)naphthalene-1-sulfonic acid CAS Name: 4-amino-6-[(2Z)-2-[6-[(4-chloro-6-methyl-1,3,5-triazin-2-yl)amino]-2-oxo-4-sulfo-1-naphthalenylidene]hydrazinyl]-5-hydroxy-3-(trihydroxy-$l^{4}-sulfanyl)-1-naphthalenesulfonic acid IUPAC Name: 4-amino-6-[(2Z)-2-[6-[(4-chloro-6-methyl-1,3,5-triazin-2-yl)amino]-2-oxo-4-sulfonaphthalen-1-ylidene]hydrazinyl]-5-hydroxy-3-(trihydroxy-$l^{4}-sulfanyl)naphthalene-1-sulfonic acid Traditional Name: 4-amino-6-[(N'Z)-N'-[6-[(4-chloro-6-methyl-s-triazin-2-yl)amino]-2-keto-4-sulfo-1-naphthylidene]hydrazino]-5-hydroxy-3-trihydroxysulfuranyl-naphthalene-1-sulfonic acid Formula: C24H20ClN7O11S3 MolecularWeight: 714.1039

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=N1)Cl)NC2=CC3=C(C=C2)C(=NNC4=C(C5=C(C=C4)C(=CC(=C5N)S(O)(O)O)S(=O)(=O)O)O)C(=O)C=C3S(=O)(=O)O

Isomeric SMILES

CC1=NC(=NC(=N1)Cl)NC2=CC3=C(C=C2)/C(=N/NC4=C(C5=C(C=C4)C(=CC(=C5N)S(O)(O)O)S(=O)(=O)O)O)/C(=O)C=C3S(=O)(=O)O

InChI

InChI=1S/C24H20ClN7O11S3/c1-9-27-23(25)30-24(28-9)29-10-2-3-11-13(6-10)16(44(35,36)37)7-15(33)21(11)32-31-14-5-4-12-17(45(38,39)40)8-18(46(41,42)43)20(26)19(12)22(14)34/h2-8,31,34,41-43H,26H2,1H3,(H,35,36,37)(H,38,39,40)(H,27,28,29,30)/b32-21-