ethyl 5-[(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[[4-chloro-3-(1-piperidylsulfonyl)phenyl]carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[4-chloro-3-(1-piperidinylsulfonyl)anilino]-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-chloro-3-piperidin-1-ylsulfonylphenyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[(4-chloro-3-piperidinosulfonyl-phenyl)carbamoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H26ClN3O5S MolecularWeight: 467.96624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C21H26ClN3O5S/c1-4-30-21(27)18-13(2)19(23-14(18)3)20(26)24-15-8-9-16(22)17(12-15)31(28,29)25-10-6-5-7-11-25/h8-9,12,23H,4-7,10-11H2,1-3H3,(H,24,26)