3-[furan-2-ylmethyl-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]amino]-N-phenethyl-propanamide

Systemtic Name: 3-[furan-2-ylmethyl-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]amino]-N-phenethyl-propanamide Openeye Name: 3-[(3-benzyl-1,2,4-thiadiazol-5-yl)-(2-furylmethyl)amino]-N-phenethyl-propanamide CAS Name: 3-[2-furanylmethyl-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]amino]-N-phenethylpropanamide IUPAC Name: 3-[(3-benzyl-1,2,4-thiadiazol-5-yl)-(furan-2-ylmethyl)amino]-N-phenethylpropanamide Traditional Name: 3-[(3-benzyl-1,2,4-thiadiazol-5-yl)-(2-furfuryl)amino]-N-phenethyl-propionamide Formula: C25H26N4O2S MolecularWeight: 446.56454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26N4O2S/c30-24(26-15-13-20-8-3-1-4-9-20)14-16-29(19-22-12-7-17-31-22)25-27-23(28-32-25)18-21-10-5-2-6-11-21/h1-12,17H,13-16,18-19H2,(H,26,30)