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

Systemtic Name: N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-(2-phenylmethoxyethanoylamino)propanamide Openeye Name: 2-[(2-benzyloxyacetyl)amino]-N-[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-[(1-oxo-2-phenylmethoxyethyl)amino]propanamide IUPAC Name: N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-2-[(2-phenylmethoxyacetyl)amino]propanamide Traditional Name: 2-[(2-benzoxyacetyl)amino]-N-[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]propionamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)C(C)NC(=O)COCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)C(C)NC(=O)COCC3=CC=CC=C3

InChI

InChI=1S/C21H22N4O3S/c1-14-7-6-10-17(11-14)20-24-25-21(29-20)23-19(27)15(2)22-18(26)13-28-12-16-8-4-3-5-9-16/h3-11,15H,12-13H2,1-2H3,(H,22,26)(H,23,25,27)