2,3-dihydro-1,4-benzodioxin-3-yl-[4-(2-methyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylpiperazin-1-yl]methanone

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-(2-methyl-5-pyrrolidin-1-ylsulfonyl-phenyl)carbonylpiperazin-1-yl]methanone Openeye Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-(2-methyl-5-pyrrolidin-1-ylsulfonyl-benzoyl)piperazin-1-yl]methanone CAS Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-[[2-methyl-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]-1-piperazinyl]methanone IUPAC Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-(2-methyl-5-pyrrolidin-1-ylsulfonylbenzoyl)piperazin-1-yl]methanone Traditional Name: 2,3-dihydro-1,4-benzodioxin-3-yl-[4-(2-methyl-5-pyrrolidinosulfonyl-benzoyl)piperazino]methanone Formula: C25H29N3O6S MolecularWeight: 499.57926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)N3CCN(CC3)C(=O)C4COC5=CC=CC=C5O4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)N3CCN(CC3)C(=O)C4COC5=CC=CC=C5O4

InChI

InChI=1S/C25H29N3O6S/c1-18-8-9-19(35(31,32)28-10-4-5-11-28)16-20(18)24(29)26-12-14-27(15-13-26)25(30)23-17-33-21-6-2-3-7-22(21)34-23/h2-3,6-9,16,23H,4-5,10-15,17H2,1H3