ethyl 2,4-dimethyl-1-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-1-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-1-[2-oxo-2-(2-thienylmethylamino)ethyl]-5-phenyl-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-1-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-1-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]-5-phenylpyrrole-3-carboxylate Traditional Name: 1-[2-keto-2-(2-thenylamino)ethyl]-2,4-dimethyl-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1C)C2=CC=CC=C2)CC(=O)NCC3=CC=CS3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C)C2=CC=CC=C2)CC(=O)NCC3=CC=CS3)C

InChI

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