2-butyl-1,3-bis(oxidanylidene)-N-[4-(piperidin-1-ylmethyl)-1,3-thiazol-2-yl]isoindole-5-carboxamide

Systemtic Name: 2-butyl-1,3-bis(oxidanylidene)-N-[4-(piperidin-1-ylmethyl)-1,3-thiazol-2-yl]isoindole-5-carboxamide Openeye Name: 2-butyl-1,3-dioxo-N-[4-(1-piperidylmethyl)thiazol-2-yl]isoindoline-5-carboxamide CAS Name: 2-butyl-1,3-dioxo-N-[4-(1-piperidinylmethyl)-2-thiazolyl]-5-isoindolecarboxamide IUPAC Name: 2-butyl-1,3-dioxo-N-[4-(piperidin-1-ylmethyl)-1,3-thiazol-2-yl]isoindole-5-carboxamide Traditional Name: 2-butyl-1,3-diketo-N-[4-(piperidinomethyl)thiazol-2-yl]isoindoline-5-carboxamide Formula: C22H26N4O3S MolecularWeight: 426.53184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=NC(=CS3)CN4CCCCC4

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=NC(=CS3)CN4CCCCC4

InChI

InChI=1S/C22H26N4O3S/c1-2-3-11-26-20(28)17-8-7-15(12-18(17)21(26)29)19(27)24-22-23-16(14-30-22)13-25-9-5-4-6-10-25/h7-8,12,14H,2-6,9-11,13H2,1H3,(H,23,24,27)