ethyl 2-(2-chloranylethanoylamino)-4,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 2-(2-chloranylethanoylamino)-4,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrole-3-carboxylate Openeye Name: ethyl 2-[(2-chloroacetyl)amino]-4,5-dimethyl-1-(2-thienylmethyl)pyrrole-3-carboxylate CAS Name: 2-[(2-chloro-1-oxoethyl)amino]-4,5-dimethyl-1-(thiophen-2-ylmethyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-chloroacetyl)amino]-4,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrole-3-carboxylate Traditional Name: 2-[(2-chloroacetyl)amino]-4,5-dimethyl-1-(2-thenyl)pyrrole-3-carboxylic acid ethyl ester Formula: C16H19ClN2O3S MolecularWeight: 354.85166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1C)C)CC2=CC=CS2)NC(=O)CCl

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C)C)CC2=CC=CS2)NC(=O)CCl

InChI

InChI=1S/C16H19ClN2O3S/c1-4-22-16(21)14-10(2)11(3)19(9-12-6-5-7-23-12)15(14)18-13(20)8-17/h5-7H,4,8-9H2,1-3H3,(H,18,20)