N-butyl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-4-hexyl-benzamide

Systemtic Name: N-butyl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-4-hexyl-benzamide Openeye Name: N-butyl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(2-thienylmethyl)amino]-2-oxo-ethyl]-4-hexyl-benzamide CAS Name: N-butyl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-4-hexylbenzamide IUPAC Name: N-butyl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-4-hexylbenzamide Traditional Name: N-butyl-4-hexyl-N-[2-[homoveratryl(2-thenyl)amino]-2-keto-ethyl]benzamide Formula: C34H46N2O4S MolecularWeight: 578.80504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N(CCCC)CC(=O)N(CCC2=CC(=C(C=C2)OC)OC)CC3=CC=CS3

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N(CCCC)CC(=O)N(CCC2=CC(=C(C=C2)OC)OC)CC3=CC=CS3

InChI

InChI=1S/C34H46N2O4S/c1-5-7-9-10-12-27-14-17-29(18-15-27)34(38)36(21-8-6-2)26-33(37)35(25-30-13-11-23-41-30)22-20-28-16-19-31(39-3)32(24-28)40-4/h11,13-19,23-24H,5-10,12,20-22,25-26H2,1-4H3