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

Systemtic Name: methyl 4-[4-aminocarbonyl-5-methyl-2-propyl-1-(2-thiophen-2-ylethyl)pyrrol-3-yl]benzoate Openeye Name: methyl 4-[4-carbamoyl-5-methyl-2-propyl-1-[2-(2-thienyl)ethyl]pyrrol-3-yl]benzoate CAS Name: 4-[4-carbamoyl-5-methyl-2-propyl-1-(2-thiophen-2-ylethyl)-3-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-carbamoyl-5-methyl-2-propyl-1-(2-thiophen-2-ylethyl)pyrrol-3-yl]benzoate Traditional Name: 4-[4-carbamoyl-5-methyl-2-propyl-1-[2-(2-thienyl)ethyl]pyrrol-3-yl]benzoic acid methyl ester Formula: C23H26N2O3S MolecularWeight: 410.52914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(N1CCC2=CC=CS2)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCCC1=C(C(=C(N1CCC2=CC=CS2)C)C(=O)N)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H26N2O3S/c1-4-6-19-21(16-8-10-17(11-9-16)23(27)28-3)20(22(24)26)15(2)25(19)13-12-18-7-5-14-29-18/h5,7-11,14H,4,6,12-13H2,1-3H3,(H2,24,26)