methyl 1-ethyl-3,5-dimethyl-4-[2-[3-methylbutyl(naphthalen-2-ylsulfonyl)amino]ethanoyl]pyrrole-2-carboxylate

Systemtic Name: methyl 1-ethyl-3,5-dimethyl-4-[2-[3-methylbutyl(naphthalen-2-ylsulfonyl)amino]ethanoyl]pyrrole-2-carboxylate Openeye Name: methyl 1-ethyl-4-[2-[isopentyl(2-naphthylsulfonyl)amino]acetyl]-3,5-dimethyl-pyrrole-2-carboxylate CAS Name: 1-ethyl-3,5-dimethyl-4-[2-[3-methylbutyl(2-naphthalenylsulfonyl)amino]-1-oxoethyl]-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-ethyl-3,5-dimethyl-4-[2-[3-methylbutyl(naphthalen-2-ylsulfonyl)amino]acetyl]pyrrole-2-carboxylate Traditional Name: 1-ethyl-4-[2-[isoamyl(2-naphthylsulfonyl)amino]acetyl]-3,5-dimethyl-pyrrole-2-carboxylic acid methyl ester Formula: C27H34N2O5S MolecularWeight: 498.63426

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C1C(=O)OC)C)C(=O)CN(CCC(C)C)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C

Isomeric SMILES

CCN1C(=C(C(=C1C(=O)OC)C)C(=O)CN(CCC(C)C)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C

InChI

InChI=1S/C27H34N2O5S/c1-7-29-20(5)25(19(4)26(29)27(31)34-6)24(30)17-28(15-14-18(2)3)35(32,33)23-13-12-21-10-8-9-11-22(21)16-23/h8-13,16,18H,7,14-15,17H2,1-6H3