[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[1-(1H-imidazol-5-ylsulfonyl)-4-piperidyl]methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-[1-(1H-imidazol-5-ylsulfonyl)-4-piperidinyl]methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-[1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]methanone Traditional Name: [1-(1H-imidazol-5-ylsulfonyl)-4-piperidyl]-(4-piperonylpiperazino)methanone Formula: C21H27N5O5S MolecularWeight: 461.53458

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CN=CN5

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CN=CN5

InChI

InChI=1S/C21H27N5O5S/c27-21(17-3-5-26(6-4-17)32(28,29)20-12-22-14-23-20)25-9-7-24(8-10-25)13-16-1-2-18-19(11-16)31-15-30-18/h1-2,11-12,14,17H,3-10,13,15H2,(H,22,23)