[5-(3,5-dimethylpiperidin-1-yl)sulfonyl-3-methyl-1-benzofuran-2-yl]-(4-methylpiperazin-1-yl)methanone

Systemtic Name: [5-(3,5-dimethylpiperidin-1-yl)sulfonyl-3-methyl-1-benzofuran-2-yl]-(4-methylpiperazin-1-yl)methanone Openeye Name: [5-[(3,5-dimethyl-1-piperidyl)sulfonyl]-3-methyl-benzofuran-2-yl]-(4-methylpiperazin-1-yl)methanone CAS Name: [5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-3-methyl-2-benzofuranyl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: [5-(3,5-dimethylpiperidin-1-yl)sulfonyl-3-methyl-1-benzofuran-2-yl]-(4-methylpiperazin-1-yl)methanone Traditional Name: [5-(3,5-dimethylpiperidino)sulfonyl-3-methyl-benzofuran-2-yl]-(4-methylpiperazino)methanone Formula: C22H31N3O4S MolecularWeight: 433.56424

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC3=C(C=C2)OC(=C3C)C(=O)N4CCN(CC4)C)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC3=C(C=C2)OC(=C3C)C(=O)N4CCN(CC4)C)C

InChI

InChI=1S/C22H31N3O4S/c1-15-11-16(2)14-25(13-15)30(27,28)18-5-6-20-19(12-18)17(3)21(29-20)22(26)24-9-7-23(4)8-10-24/h5-6,12,15-16H,7-11,13-14H2,1-4H3