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

Systemtic Name: 4-(3,4-dimethoxyphenyl)sulfonyl-N-phenethyl-piperazine-1-carboxamide Openeye Name: 4-(3,4-dimethoxyphenyl)sulfonyl-N-phenethyl-piperazine-1-carboxamide CAS Name: 4-(3,4-dimethoxyphenyl)sulfonyl-N-phenethyl-1-piperazinecarboxamide IUPAC Name: 4-(3,4-dimethoxyphenyl)sulfonyl-N-phenethylpiperazine-1-carboxamide Traditional Name: 4-(3,4-dimethoxyphenyl)sulfonyl-N-phenethyl-piperazine-1-carboxamide Formula: C21H27N3O5S MolecularWeight: 433.52118

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NCCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NCCC3=CC=CC=C3)OC

InChI

InChI=1S/C21H27N3O5S/c1-28-19-9-8-18(16-20(19)29-2)30(26,27)24-14-12-23(13-15-24)21(25)22-11-10-17-6-4-3-5-7-17/h3-9,16H,10-15H2,1-2H3,(H,22,25)