methyl 4-[[4-(4-indol-1-ylbutanoylamino)-1-methyl-pyrrol-2-yl]carbonylamino]-1-methyl-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[[4-(4-indol-1-ylbutanoylamino)-1-methyl-pyrrol-2-yl]carbonylamino]-1-methyl-pyrrole-2-carboxylate Openeye Name: methyl 4-[[4-(4-indol-1-ylbutanoylamino)-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrole-2-carboxylate CAS Name: 4-[[[4-[[4-(1-indolyl)-1-oxobutyl]amino]-1-methyl-2-pyrrolyl]-oxomethyl]amino]-1-methyl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[[4-(4-indol-1-ylbutanoylamino)-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrole-2-carboxylate Traditional Name: 4-[[4-(4-indol-1-ylbutanoylamino)-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrole-2-carboxylic acid methyl ester Formula: C25H27N5O4 MolecularWeight: 461.51298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)OC)C)NC(=O)CCCN3C=CC4=CC=CC=C43

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2=CN(C(=C2)C(=O)OC)C)NC(=O)CCCN3C=CC4=CC=CC=C43

InChI

InChI=1S/C25H27N5O4/c1-28-15-18(13-21(28)24(32)27-19-14-22(25(33)34-3)29(2)16-19)26-23(31)9-6-11-30-12-10-17-7-4-5-8-20(17)30/h4-5,7-8,10,12-16H,6,9,11H2,1-3H3,(H,26,31)(H,27,32)