N-[(2,3-dimethoxyphenyl)methyl]-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-N-methyl-benzamide

Systemtic Name: N-[(2,3-dimethoxyphenyl)methyl]-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-N-methyl-benzamide Openeye Name: N-[(2,3-dimethoxyphenyl)methyl]-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-N-methyl-benzamide CAS Name: N-[(2,3-dimethoxyphenyl)methyl]-3-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl]-N-methylbenzamide IUPAC Name: N-[(2,3-dimethoxyphenyl)methyl]-3-[4-(4-fluorophenyl)piperazin-1-yl]sulfonyl-N-methylbenzamide Traditional Name: 3-[4-(4-fluorophenyl)piperazino]sulfonyl-N-methyl-N-o-veratryl-benzamide Formula: C27H30FN3O5S MolecularWeight: 527.607603

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C(=CC=C1)OC)OC)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CN(CC1=C(C(=CC=C1)OC)OC)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H30FN3O5S/c1-29(19-21-7-5-9-25(35-2)26(21)36-3)27(32)20-6-4-8-24(18-20)37(33,34)31-16-14-30(15-17-31)23-12-10-22(28)11-13-23/h4-13,18H,14-17,19H2,1-3H3