ethyl 2,4-dimethyl-5-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)carbonyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)carbonyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[4-(2-naphthylsulfonyl)piperazine-1-carbonyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-oxomethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-(4-naphthalen-2-ylsulfonylpiperazine-1-carbonyl)-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-[4-(2-naphthylsulfonyl)piperazine-1-carbonyl]-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C24H27N3O5S MolecularWeight: 469.55328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)C

InChI

InChI=1S/C24H27N3O5S/c1-4-32-24(29)21-16(2)22(25-17(21)3)23(28)26-11-13-27(14-12-26)33(30,31)20-10-9-18-7-5-6-8-19(18)15-20/h5-10,15,25H,4,11-14H2,1-3H3