1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]-2-[(phenylmethyl)-propan-2-yl-amino]ethanone

Systemtic Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]-2-[(phenylmethyl)-propan-2-yl-amino]ethanone Openeye Name: 2-[benzyl(isopropyl)amino]-1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]ethanone CAS Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-piperazinyl]-2-[(phenylmethyl)-propan-2-ylamino]ethanone IUPAC Name: 2-[benzyl(propan-2-yl)amino]-1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]ethanone Traditional Name: 2-[benzyl(isopropyl)amino]-1-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazino]ethanone Formula: C24H31N3O5S MolecularWeight: 473.58504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C24H31N3O5S/c1-19(2)26(17-20-6-4-3-5-7-20)18-24(28)25-10-12-27(13-11-25)33(29,30)21-8-9-22-23(16-21)32-15-14-31-22/h3-9,16,19H,10-15,17-18H2,1-2H3