methyl 3-[2,5-dimethyl-3-[[(5-nitro-1-benzothiophen-2-yl)carbonylhydrazinylidene]methyl]pyrrol-1-yl]benzoate

Systemtic Name: methyl 3-[2,5-dimethyl-3-[[(5-nitro-1-benzothiophen-2-yl)carbonylhydrazinylidene]methyl]pyrrol-1-yl]benzoate Openeye Name: methyl 3-[2,5-dimethyl-3-[[(5-nitrobenzothiophene-2-carbonyl)hydrazono]methyl]pyrrol-1-yl]benzoate CAS Name: 3-[2,5-dimethyl-3-[[[(5-nitro-1-benzothiophen-2-yl)-oxomethyl]hydrazinylidene]methyl]-1-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 3-[2,5-dimethyl-3-[[(5-nitro-1-benzothiophene-2-carbonyl)hydrazinylidene]methyl]pyrrol-1-yl]benzoate Traditional Name: 3-[2,5-dimethyl-3-[[(5-nitrobenzothiophene-2-carbonyl)hydrazono]methyl]pyrrol-1-yl]benzoic acid methyl ester Formula: C24H20N4O5S MolecularWeight: 476.5044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC(=C2)C(=O)OC)C)C=NNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC(=C2)C(=O)OC)C)C=NNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H20N4O5S/c1-14-9-18(15(2)27(14)19-6-4-5-16(10-19)24(30)33-3)13-25-26-23(29)22-12-17-11-20(28(31)32)7-8-21(17)34-22/h4-13H,1-3H3,(H,26,29)