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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC(=C2C)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(=C2C)C(=O)OC)C)C=NNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

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