methyl 3-[2,5-dimethyl-3-[[(5-nitro-1-benzothiophen-2-yl)carbonylhydrazinylidene]methyl]pyrrol-1-yl]-4-methyl-benzoate

Systemtic Name: methyl 3-[2,5-dimethyl-3-[[(5-nitro-1-benzothiophen-2-yl)carbonylhydrazinylidene]methyl]pyrrol-1-yl]-4-methyl-benzoate Openeye Name: methyl 3-[2,5-dimethyl-3-[[(5-nitrobenzothiophene-2-carbonyl)hydrazono]methyl]pyrrol-1-yl]-4-methyl-benzoate CAS Name: 3-[2,5-dimethyl-3-[[[(5-nitro-1-benzothiophen-2-yl)-oxomethyl]hydrazinylidene]methyl]-1-pyrrolyl]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[2,5-dimethyl-3-[[(5-nitro-1-benzothiophene-2-carbonyl)hydrazinylidene]methyl]pyrrol-1-yl]-4-methylbenzoate Traditional Name: 3-[2,5-dimethyl-3-[[(5-nitrobenzothiophene-2-carbonyl)hydrazono]methyl]pyrrol-1-yl]-4-methyl-benzoic acid methyl ester Formula: C25H22N4O5S MolecularWeight: 490.53098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)N2C(=CC(=C2C)C=NNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)N2C(=CC(=C2C)C=NNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])C

InChI

InChI=1S/C25H22N4O5S/c1-14-5-6-17(25(31)34-4)11-21(14)28-15(2)9-19(16(28)3)13-26-27-24(30)23-12-18-10-20(29(32)33)7-8-22(18)35-23/h5-13H,1-4H3,(H,27,30)