N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-3-phenyl-2-(2-phenylmethoxyethanoylamino)propanamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-3-phenyl-2-(2-phenylmethoxyethanoylamino)propanamide Openeye Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-2-[(2-benzyloxyacetyl)amino]-3-phenyl-propanamide CAS Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-2-[(1-oxo-2-phenylmethoxyethyl)amino]-3-phenylpropanamide IUPAC Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-3-phenyl-2-[(2-phenylmethoxyacetyl)amino]propanamide Traditional Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-2-[(2-benzoxyacetyl)amino]-3-phenyl-propionamide Formula: C27H24N4O5S MolecularWeight: 516.56826

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NN=C(S3)NC(=O)C(CC4=CC=CC=C4)NC(=O)COCC5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NN=C(S3)NC(=O)C(CC4=CC=CC=C4)NC(=O)COCC5=CC=CC=C5

InChI

InChI=1S/C27H24N4O5S/c32-24(16-34-15-19-9-5-2-6-10-19)28-21(13-18-7-3-1-4-8-18)25(33)29-27-31-30-26(37-27)20-11-12-22-23(14-20)36-17-35-22/h1-12,14,21H,13,15-17H2,(H,28,32)(H,29,31,33)