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

Systemtic Name: N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-N-prop-2-enyl-cyclohexanecarboxamide Openeye Name: N-allyl-N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(2-thienylmethyl)amino]-2-oxo-ethyl]cyclohexanecarboxamide CAS Name: N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-N-prop-2-enylcyclohexanecarboxamide IUPAC Name: N-[2-[2-(3,4-dimethoxyphenyl)ethyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-N-prop-2-enylcyclohexanecarboxamide Traditional Name: N-allyl-N-[2-[homoveratryl(2-thenyl)amino]-2-keto-ethyl]cyclohexanecarboxamide Formula: C27H36N2O4S MolecularWeight: 484.65074

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN(CC2=CC=CS2)C(=O)CN(CC=C)C(=O)C3CCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN(CC2=CC=CS2)C(=O)CN(CC=C)C(=O)C3CCCCC3)OC

InChI

InChI=1S/C27H36N2O4S/c1-4-15-29(27(31)22-9-6-5-7-10-22)20-26(30)28(19-23-11-8-17-34-23)16-14-21-12-13-24(32-2)25(18-21)33-3/h4,8,11-13,17-18,22H,1,5-7,9-10,14-16,19-20H2,2-3H3