4-butyl-N-[2-[1-nonyl-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylethyl]benzamide

Systemtic Name: 4-butyl-N-[2-[1-nonyl-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylethyl]benzamide Openeye Name: 4-butyl-N-[2-(1-nonyl-2,5-dioxo-pyrrolidin-3-yl)sulfanylethyl]benzamide CAS Name: 4-butyl-N-[2-[(1-nonyl-2,5-dioxo-3-pyrrolidinyl)thio]ethyl]benzamide IUPAC Name: 4-butyl-N-[2-(1-nonyl-2,5-dioxopyrrolidin-3-yl)sulfanylethyl]benzamide Traditional Name: 4-butyl-N-[2-[(2,5-diketo-1-nonyl-pyrrolidin-3-yl)thio]ethyl]benzamide Formula: C26H40N2O3S MolecularWeight: 460.6724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCN1C(=O)CC(C1=O)SCCNC(=O)C2=CC=C(C=C2)CCCC

Isomeric SMILES

CCCCCCCCCN1C(=O)CC(C1=O)SCCNC(=O)C2=CC=C(C=C2)CCCC

InChI

InChI=1S/C26H40N2O3S/c1-3-5-7-8-9-10-11-18-28-24(29)20-23(26(28)31)32-19-17-27-25(30)22-15-13-21(14-16-22)12-6-4-2/h13-16,23H,3-12,17-20H2,1-2H3,(H,27,30)