ethyl 4-[(4-piperidin-1-ylsulfonyl-1H-pyrrol-2-yl)carbonyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(4-piperidin-1-ylsulfonyl-1H-pyrrol-2-yl)carbonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[4-(1-piperidylsulfonyl)-1H-pyrrole-2-carbonyl]piperazine-1-carboxylate CAS Name: 4-[oxo-[4-(1-piperidinylsulfonyl)-1H-pyrrol-2-yl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-piperidin-1-ylsulfonyl-1H-pyrrole-2-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(4-piperidinosulfonyl-1H-pyrrole-2-carbonyl)piperazine-1-carboxylic acid ethyl ester Formula: C17H26N4O5S MolecularWeight: 398.47714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=CN2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=CN2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C17H26N4O5S/c1-2-26-17(23)20-10-8-19(9-11-20)16(22)15-12-14(13-18-15)27(24,25)21-6-4-3-5-7-21/h12-13,18H,2-11H2,1H3