ethyl 2,4-dimethyl-5-[(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)carbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[(2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl)carbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[[2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]carbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-[[2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]amino]methyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)carbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[[2-pyrrolidino-2-(2-thienyl)ethyl]carbamoyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)NCC(C2=CC=CS2)N3CCCC3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)NCC(C2=CC=CS2)N3CCCC3)C

InChI

InChI=1S/C20H27N3O3S/c1-4-26-20(25)17-13(2)18(22-14(17)3)19(24)21-12-15(16-8-7-11-27-16)23-9-5-6-10-23/h7-8,11,15,22H,4-6,9-10,12H2,1-3H3,(H,21,24)