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

Systemtic Name: N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-N-prop-2-enyl-octanamide Openeye Name: N-allyl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(2-thienylmethyl)amino]-2-oxo-ethyl]octanamide CAS Name: N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-N-prop-2-enyloctanamide IUPAC Name: N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-N-prop-2-enyloctanamide Traditional Name: N-allyl-N-[2-[homoveratryl(2-thenyl)amino]-2-keto-ethyl]caprylamide Formula: C28H40N2O4S MolecularWeight: 500.6932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N(CC=C)CC(=O)N(CCC1=CC(=C(C=C1)OC)OC)CC2=CC=CS2

Isomeric SMILES

CCCCCCCC(=O)N(CC=C)CC(=O)N(CCC1=CC(=C(C=C1)OC)OC)CC2=CC=CS2

InChI

InChI=1S/C28H40N2O4S/c1-5-7-8-9-10-13-27(31)29(17-6-2)22-28(32)30(21-24-12-11-19-35-24)18-16-23-14-15-25(33-3)26(20-23)34-4/h6,11-12,14-15,19-20H,2,5,7-10,13,16-18,21-22H2,1,3-4H3