methyl 4-[4-aminocarbonyl-2-butyl-5-methyl-1-(2-thiophen-2-ylethyl)pyrrol-3-yl]benzoate

Systemtic Name: methyl 4-[4-aminocarbonyl-2-butyl-5-methyl-1-(2-thiophen-2-ylethyl)pyrrol-3-yl]benzoate Openeye Name: methyl 4-[2-butyl-4-carbamoyl-5-methyl-1-[2-(2-thienyl)ethyl]pyrrol-3-yl]benzoate CAS Name: 4-[2-butyl-4-carbamoyl-5-methyl-1-(2-thiophen-2-ylethyl)-3-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-butyl-4-carbamoyl-5-methyl-1-(2-thiophen-2-ylethyl)pyrrol-3-yl]benzoate Traditional Name: 4-[2-butyl-4-carbamoyl-5-methyl-1-[2-(2-thienyl)ethyl]pyrrol-3-yl]benzoic acid methyl ester Formula: C24H28N2O3S MolecularWeight: 424.55572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CCC2=CC=CS2)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCCC1=C(C(=C(N1CCC2=CC=CS2)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C24H28N2O3S/c1-4-5-8-20-22(17-9-11-18(12-10-17)24(28)29-3)21(23(25)27)16(2)26(20)14-13-19-7-6-15-30-19/h6-7,9-12,15H,4-5,8,13-14H2,1-3H3,(H2,25,27)