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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[furan-2-ylmethyl-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]propanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[2-furylmethyl-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]propanamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[2-furanylmethyl-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]propanamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[furan-2-ylmethyl-[3-[(3-methoxyphenyl)methyl]-1,2,4-thiadiazol-5-yl]amino]propanamide Traditional Name: 3-[2-furfuryl-(3-m-anisyl-1,2,4-thiadiazol-5-yl)amino]-N-homoveratryl-propionamide Formula: C28H32N4O5S MolecularWeight: 536.64248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CCN(CC2=CC=CO2)C3=NC(=NS3)CC4=CC(=CC=C4)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CCN(CC2=CC=CO2)C3=NC(=NS3)CC4=CC(=CC=C4)OC)OC

InChI

InChI=1S/C28H32N4O5S/c1-34-22-7-4-6-21(16-22)18-26-30-28(38-31-26)32(19-23-8-5-15-37-23)14-12-27(33)29-13-11-20-9-10-24(35-2)25(17-20)36-3/h4-10,15-17H,11-14,18-19H2,1-3H3,(H,29,33)