N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-4-(4-methylpiperidin-1-yl)sulfonyl-pyrrole-2-carboxamide

Systemtic Name: N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-4-(4-methylpiperidin-1-yl)sulfonyl-pyrrole-2-carboxamide Openeye Name: N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-4-[(4-methyl-1-piperidyl)sulfonyl]pyrrole-2-carboxamide CAS Name: N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-4-[(4-methyl-1-piperidinyl)sulfonyl]-2-pyrrolecarboxamide IUPAC Name: N-[(2,5-dimethoxyphenyl)methyl]-1-methyl-4-(4-methylpiperidin-1-yl)sulfonylpyrrole-2-carboxamide Traditional Name: N-(2,5-dimethoxybenzyl)-1-methyl-4-(4-methylpiperidino)sulfonyl-pyrrole-2-carboxamide Formula: C21H29N3O5S MolecularWeight: 435.53706

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CN(C(=C2)C(=O)NCC3=C(C=CC(=C3)OC)OC)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CN(C(=C2)C(=O)NCC3=C(C=CC(=C3)OC)OC)C

InChI

InChI=1S/C21H29N3O5S/c1-15-7-9-24(10-8-15)30(26,27)18-12-19(23(2)14-18)21(25)22-13-16-11-17(28-3)5-6-20(16)29-4/h5-6,11-12,14-15H,7-10,13H2,1-4H3,(H,22,25)