4-(4-ethoxyphenyl)sulfonyl-N-[2-(3-methylphenoxy)ethyl]piperazine-1-carboxamide

Systemtic Name: 4-(4-ethoxyphenyl)sulfonyl-N-[2-(3-methylphenoxy)ethyl]piperazine-1-carboxamide Openeye Name: 4-(4-ethoxyphenyl)sulfonyl-N-[2-(3-methylphenoxy)ethyl]piperazine-1-carboxamide CAS Name: 4-(4-ethoxyphenyl)sulfonyl-N-[2-(3-methylphenoxy)ethyl]-1-piperazinecarboxamide IUPAC Name: 4-(4-ethoxyphenyl)sulfonyl-N-[2-(3-methylphenoxy)ethyl]piperazine-1-carboxamide Traditional Name: N-[2-(3-methylphenoxy)ethyl]-4-p-phenetylsulfonyl-piperazine-1-carboxamide Formula: C22H29N3O5S MolecularWeight: 447.54776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NCCOC3=CC=CC(=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NCCOC3=CC=CC(=C3)C

InChI

InChI=1S/C22H29N3O5S/c1-3-29-19-7-9-21(10-8-19)31(27,28)25-14-12-24(13-15-25)22(26)23-11-16-30-20-6-4-5-18(2)17-20/h4-10,17H,3,11-16H2,1-2H3,(H,23,26)