2-[(2E)-2-[6-[(4-azanyl-6-chloranyl-1,3,5-triazin-2-yl)-methyl-amino]-3-methyl-1-oxidanylidene-naphthalen-2-ylidene]hydrazinyl]naphthalene-1,5-disulfonic acid

Systemtic Name: 2-[(2E)-2-[6-[(4-azanyl-6-chloranyl-1,3,5-triazin-2-yl)-methyl-amino]-3-methyl-1-oxidanylidene-naphthalen-2-ylidene]hydrazinyl]naphthalene-1,5-disulfonic acid Openeye Name: 2-[(2E)-2-[6-[(4-amino-6-chloro-1,3,5-triazin-2-yl)-methyl-amino]-3-methyl-1-oxo-2-naphthylidene]hydrazino]naphthalene-1,5-disulfonic acid CAS Name: 2-[(2E)-2-[6-[(4-amino-6-chloro-1,3,5-triazin-2-yl)-methylamino]-3-methyl-1-oxo-2-naphthalenylidene]hydrazinyl]naphthalene-1,5-disulfonic acid IUPAC Name: 2-[(2E)-2-[6-[(4-amino-6-chloro-1,3,5-triazin-2-yl)-methylamino]-3-methyl-1-oxonaphthalen-2-ylidene]hydrazinyl]naphthalene-1,5-disulfonic acid Traditional Name: 2-[(N'E)-N'-[6-[(4-amino-6-chloro-s-triazin-2-yl)-methyl-amino]-1-keto-3-methyl-2-naphthylidene]hydrazino]naphthalene-1,5-disulfonic acid Formula: C25H20ClN7O7S2 MolecularWeight: 630.052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC(=C2)N(C)C3=NC(=NC(=N3)N)Cl)C(=O)C1=NNC4=C(C5=C(C=C4)C(=CC=C5)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CC\1=CC2=C(C=CC(=C2)N(C)C3=NC(=NC(=N3)N)Cl)C(=O)/C1=N/NC4=C(C5=C(C=C4)C(=CC=C5)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C25H20ClN7O7S2/c1-12-10-13-11-14(33(2)25-29-23(26)28-24(27)30-25)6-7-15(13)21(34)20(12)32-31-18-9-8-16-17(22(18)42(38,39)40)4-3-5-19(16)41(35,36)37/h3-11,31H,1-2H3,(H,35,36,37)(H,38,39,40)(H2,27,28,29,30)/b32-20+