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

Systemtic Name: methyl 4-[4-aminocarbonyl-2-ethyl-5-methyl-1-(2-thiophen-2-ylethyl)pyrrol-3-yl]benzoate Openeye Name: methyl 4-[4-carbamoyl-2-ethyl-5-methyl-1-[2-(2-thienyl)ethyl]pyrrol-3-yl]benzoate CAS Name: 4-[4-carbamoyl-2-ethyl-5-methyl-1-(2-thiophen-2-ylethyl)-3-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-carbamoyl-2-ethyl-5-methyl-1-(2-thiophen-2-ylethyl)pyrrol-3-yl]benzoate Traditional Name: 4-[4-carbamoyl-2-ethyl-5-methyl-1-[2-(2-thienyl)ethyl]pyrrol-3-yl]benzoic acid methyl ester Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1CCC2=CC=CS2)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1CCC2=CC=CS2)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H24N2O3S/c1-4-18-20(15-7-9-16(10-8-15)22(26)27-3)19(21(23)25)14(2)24(18)12-11-17-6-5-13-28-17/h5-10,13H,4,11-12H2,1-3H3,(H2,23,25)