dilithium 3-[(2E)-2-[3-(4-acetamidophenyl)-5-azanylidene-4-cyano-thiophen-2-ylidene]hydrazinyl]naphthalene-1,5-disulfonate

Systemtic Name: dilithium 3-[(2E)-2-[3-(4-acetamidophenyl)-5-azanylidene-4-cyano-thiophen-2-ylidene]hydrazinyl]naphthalene-1,5-disulfonate Openeye Name: dilithium 3-[(2E)-2-[3-(4-acetamidophenyl)-4-cyano-5-imino-2-thienylidene]hydrazino]naphthalene-1,5-disulfonate CAS Name: dilithium 3-[(2E)-2-[3-(4-acetamidophenyl)-4-cyano-5-imino-2-thiophenylidene]hydrazinyl]naphthalene-1,5-disulfonate IUPAC Name: dilithium 3-[(2E)-2-[3-(4-acetamidophenyl)-4-cyano-5-iminothiophen-2-ylidene]hydrazinyl]naphthalene-1,5-disulfonate Traditional Name: dilithium 3-[(N'E)-N'-[3-(4-acetamidophenyl)-4-cyano-5-imino-2-thienylidene]hydrazino]naphthalene-1,5-disulfonate Formula: C23H15Li2N5O7S3 MolecularWeight: 583.4715

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].[Li+].CC(=O)NC1=CC=C(C=C1)C2=C(C(=N)SC2=NNC3=CC(=C4C=CC=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])C#N

Isomeric SMILES

[Li+].[Li+].CC(=O)NC1=CC=C(C=C1)C\2=C(C(=N)S/C2=N/NC3=CC(=C4C=CC=C(C4=C3)S(=O)(=O)[O-])S(=O)(=O)[O-])C#N

InChI

InChI=1S/C23H17N5O7S3.2Li/c1-12(29)26-14-7-5-13(6-8-14)21-18(11-24)22(25)36-23(21)28-27-15-9-17-16(20(10-15)38(33,34)35)3-2-4-19(17)37(30,31)32;;/h2-10,25,27H,1H3,(H,26,29)(H,30,31,32)(H,33,34,35);;/q;2*+1/p-2/b25-22?,28-23+;;