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

Systemtic Name: N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-4-hexyl-N-prop-2-enyl-benzamide Openeye Name: N-allyl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(2-thienylmethyl)amino]-2-oxo-ethyl]-4-hexyl-benzamide CAS Name: N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-4-hexyl-N-prop-2-enylbenzamide IUPAC Name: N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-4-hexyl-N-prop-2-enylbenzamide Traditional Name: N-allyl-4-hexyl-N-[2-[homoveratryl(2-thenyl)amino]-2-keto-ethyl]benzamide Formula: C33H42N2O4S MolecularWeight: 562.76258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H42N2O4S/c1-5-7-8-9-11-26-13-16-28(17-14-26)33(37)35(20-6-2)25-32(36)34(24-29-12-10-22-40-29)21-19-27-15-18-30(38-3)31(23-27)39-4/h6,10,12-18,22-23H,2,5,7-9,11,19-21,24-25H2,1,3-4H3