methyl 3-[[(2,3-dimethyl-1H-indol-7-yl)carbonylamino]methyl]-5-(2-thiophen-3-ylethanoylamino)benzoate

Systemtic Name: methyl 3-[[(2,3-dimethyl-1H-indol-7-yl)carbonylamino]methyl]-5-(2-thiophen-3-ylethanoylamino)benzoate Openeye Name: methyl 3-[[(2,3-dimethyl-1H-indole-7-carbonyl)amino]methyl]-5-[[2-(3-thienyl)acetyl]amino]benzoate CAS Name: 3-[[[(2,3-dimethyl-1H-indol-7-yl)-oxomethyl]amino]methyl]-5-[[1-oxo-2-(3-thiophenyl)ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[(2,3-dimethyl-1H-indole-7-carbonyl)amino]methyl]-5-[(2-thiophen-3-ylacetyl)amino]benzoate Traditional Name: 3-[[(2,3-dimethyl-1H-indole-7-carbonyl)amino]methyl]-5-[[2-(3-thienyl)acetyl]amino]benzoic acid methyl ester Formula: C26H25N3O4S MolecularWeight: 475.5594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=CC=C2C(=O)NCC3=CC(=CC(=C3)C(=O)OC)NC(=O)CC4=CSC=C4)C

Isomeric SMILES

CC1=C(NC2=C1C=CC=C2C(=O)NCC3=CC(=CC(=C3)C(=O)OC)NC(=O)CC4=CSC=C4)C

InChI

InChI=1S/C26H25N3O4S/c1-15-16(2)28-24-21(15)5-4-6-22(24)25(31)27-13-18-9-19(26(32)33-3)12-20(10-18)29-23(30)11-17-7-8-34-14-17/h4-10,12,14,28H,11,13H2,1-3H3,(H,27,31)(H,29,30)