(5-methyl-4-pyrrolidin-1-ylsulfonyl-furan-2-yl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: (5-methyl-4-pyrrolidin-1-ylsulfonyl-furan-2-yl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone Openeye Name: (5-methyl-4-pyrrolidin-1-ylsulfonyl-2-furyl)-[4-(4-pyridylmethyl)piperazin-1-yl]methanone CAS Name: [5-methyl-4-(1-pyrrolidinylsulfonyl)-2-furanyl]-[4-(pyridin-4-ylmethyl)-1-piperazinyl]methanone IUPAC Name: (5-methyl-4-pyrrolidin-1-ylsulfonylfuran-2-yl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone Traditional Name: (5-methyl-4-pyrrolidinosulfonyl-2-furyl)-[4-(4-pyridylmethyl)piperazino]methanone Formula: C20H26N4O4S MolecularWeight: 418.50984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(=O)N2CCN(CC2)CC3=CC=NC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CC1=C(C=C(O1)C(=O)N2CCN(CC2)CC3=CC=NC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C20H26N4O4S/c1-16-19(29(26,27)24-8-2-3-9-24)14-18(28-16)20(25)23-12-10-22(11-13-23)15-17-4-6-21-7-5-17/h4-7,14H,2-3,8-13,15H2,1H3