4-(3,4-dimethoxyphenyl)sulfonyl-N-(phenylmethyl)piperazine-1-carboxamide

Systemtic Name: 4-(3,4-dimethoxyphenyl)sulfonyl-N-(phenylmethyl)piperazine-1-carboxamide Openeye Name: N-benzyl-4-(3,4-dimethoxyphenyl)sulfonyl-piperazine-1-carboxamide CAS Name: 4-(3,4-dimethoxyphenyl)sulfonyl-N-(phenylmethyl)-1-piperazinecarboxamide IUPAC Name: N-benzyl-4-(3,4-dimethoxyphenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-benzyl-4-(3,4-dimethoxyphenyl)sulfonyl-piperazine-1-carboxamide Formula: C20H25N3O5S MolecularWeight: 419.4946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NCC3=CC=CC=C3)OC

InChI

InChI=1S/C20H25N3O5S/c1-27-18-9-8-17(14-19(18)28-2)29(25,26)23-12-10-22(11-13-23)20(24)21-15-16-6-4-3-5-7-16/h3-9,14H,10-13,15H2,1-2H3,(H,21,24)