3-[2-(3,4-dimethoxyphenyl)ethyl-(2,2-diphenylethanoyl)amino]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethyl-(2,2-diphenylethanoyl)amino]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: 3-[2-(3,4-dimethoxyphenyl)ethyl-(2,2-diphenylacetyl)amino]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: 3-[2-(3,4-dimethoxyphenyl)ethyl-(1-oxo-2,2-diphenylethyl)amino]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 3-[2-(3,4-dimethoxyphenyl)ethyl-(2,2-diphenylacetyl)amino]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: 3-[(2,2-diphenylacetyl)-homoveratryl-amino]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]propionamide Formula: C36H36N4O5S MolecularWeight: 636.75984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)CCN(CCC3=CC(=C(C=C3)OC)OC)C(=O)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)CCN(CCC3=CC(=C(C=C3)OC)OC)C(=O)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C36H36N4O5S/c1-43-29-17-15-28(16-18-29)34-38-39-36(46-34)37-32(41)21-23-40(22-20-25-14-19-30(44-2)31(24-25)45-3)35(42)33(26-10-6-4-7-11-26)27-12-8-5-9-13-27/h4-19,24,33H,20-23H2,1-3H3,(H,37,39,41)