4-(4-cyanophenyl)sulfonyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazine-1-carboxamide

Systemtic Name: 4-(4-cyanophenyl)sulfonyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazine-1-carboxamide Openeye Name: 4-(4-cyanophenyl)sulfonyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazine-1-carboxamide CAS Name: 4-(4-cyanophenyl)sulfonyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-piperazinecarboxamide IUPAC Name: 4-(4-cyanophenyl)sulfonyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazine-1-carboxamide Traditional Name: 4-(4-cyanophenyl)sulfonyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazine-1-carboxamide Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCC2=CC3=C(C=C2)OCCO3)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CN(CCN1C(=O)NCC2=CC3=C(C=C2)OCCO3)S(=O)(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H22N4O5S/c22-14-16-1-4-18(5-2-16)31(27,28)25-9-7-24(8-10-25)21(26)23-15-17-3-6-19-20(13-17)30-12-11-29-19/h1-6,13H,7-12,15H2,(H,23,26)