N-[4-(cyanomethoxymethyl)-1-(ethoxymethoxy)-5-sulfanyl-pentan-2-yl]-4-phenoxy-benzamide

Systemtic Name: N-[4-(cyanomethoxymethyl)-1-(ethoxymethoxy)-5-sulfanyl-pentan-2-yl]-4-phenoxy-benzamide Openeye Name: N-[3-(cyanomethoxymethyl)-1-(ethoxymethoxymethyl)-4-sulfanyl-butyl]-4-phenoxy-benzamide CAS Name: N-[4-(cyanomethoxymethyl)-1-(ethoxymethoxy)-5-mercaptopentan-2-yl]-4-phenoxybenzamide IUPAC Name: N-[4-(cyanomethoxymethyl)-1-(ethoxymethoxy)-5-sulfanylpentan-2-yl]-4-phenoxybenzamide Traditional Name: N-[3-(cyanomethoxymethyl)-1-(ethoxymethoxymethyl)-4-mercapto-butyl]-4-phenoxy-benzamide Formula: C24H30N2O5S MolecularWeight: 458.5704

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Descriptors Computed from Structure

Canonical SMILES:

CCOCOCC(CC(COCC#N)CS)NC(=O)C1=CC=C(C=C1)OC2=CC=CC=C2

Isomeric SMILES

CCOCOCC(CC(COCC#N)CS)NC(=O)C1=CC=C(C=C1)OC2=CC=CC=C2

InChI

InChI=1S/C24H30N2O5S/c1-2-28-18-30-16-21(14-19(17-32)15-29-13-12-25)26-24(27)20-8-10-23(11-9-20)31-22-6-4-3-5-7-22/h3-11,19,21,32H,2,13-18H2,1H3,(H,26,27)