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

Systemtic Name: [5-(3,5-dimethylpiperidin-1-yl)sulfonyl-1-benzofuran-2-yl]-(4-methylpiperazin-1-yl)methanone Openeye Name: [5-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzofuran-2-yl]-(4-methylpiperazin-1-yl)methanone CAS Name: [5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-2-benzofuranyl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: [5-(3,5-dimethylpiperidin-1-yl)sulfonyl-1-benzofuran-2-yl]-(4-methylpiperazin-1-yl)methanone Traditional Name: [5-(3,5-dimethylpiperidino)sulfonylbenzofuran-2-yl]-(4-methylpiperazino)methanone Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC3=C(C=C2)OC(=C3)C(=O)N4CCN(CC4)C)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC3=C(C=C2)OC(=C3)C(=O)N4CCN(CC4)C)C

InChI

InChI=1S/C21H29N3O4S/c1-15-10-16(2)14-24(13-15)29(26,27)18-4-5-19-17(11-18)12-20(28-19)21(25)23-8-6-22(3)7-9-23/h4-5,11-12,15-16H,6-10,13-14H2,1-3H3