2-butyl-1,3-bis(oxidanylidene)-N-(1-propylsulfonylpiperidin-4-yl)isoindole-5-carboxamide

Systemtic Name: 2-butyl-1,3-bis(oxidanylidene)-N-(1-propylsulfonylpiperidin-4-yl)isoindole-5-carboxamide Openeye Name: 2-butyl-1,3-dioxo-N-(1-propylsulfonyl-4-piperidyl)isoindoline-5-carboxamide CAS Name: 2-butyl-1,3-dioxo-N-(1-propylsulfonyl-4-piperidinyl)-5-isoindolecarboxamide IUPAC Name: 2-butyl-1,3-dioxo-N-(1-propylsulfonylpiperidin-4-yl)isoindole-5-carboxamide Traditional Name: 2-butyl-1,3-diketo-N-(1-propylsulfonyl-4-piperidyl)isoindoline-5-carboxamide Formula: C21H29N3O5S MolecularWeight: 435.53706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3CCN(CC3)S(=O)(=O)CCC

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3CCN(CC3)S(=O)(=O)CCC

InChI

InChI=1S/C21H29N3O5S/c1-3-5-10-24-20(26)17-7-6-15(14-18(17)21(24)27)19(25)22-16-8-11-23(12-9-16)30(28,29)13-4-2/h6-7,14,16H,3-5,8-13H2,1-2H3,(H,22,25)