ethyl 5-[2-[[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]amino]ethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[2-[[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]amino]ethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[2-[5-(azepan-1-ylsulfonyl)-2-methoxy-anilino]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[5-(1-azepanylsulfonyl)-2-methoxyanilino]-1-oxoethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[5-(azepan-1-ylsulfonyl)-2-methoxyanilino]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[5-(azepan-1-ylsulfonyl)-2-methoxy-anilino]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C24H33N3O6S MolecularWeight: 491.60032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)CNC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)CNC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC)C

InChI

InChI=1S/C24H33N3O6S/c1-5-33-24(29)22-16(2)23(26-17(22)3)20(28)15-25-19-14-18(10-11-21(19)32-4)34(30,31)27-12-8-6-7-9-13-27/h10-11,14,25-26H,5-9,12-13,15H2,1-4H3