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

Systemtic Name: N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-3-(2-phenylmethoxyethanoylamino)propanamide Openeye Name: 3-[(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]-3-[(1-oxo-2-phenylmethoxyethyl)amino]propanamide IUPAC Name: N-[5-(3-methylphenyl)-1,3,4-thiadiazol-2-yl]-3-[(2-phenylmethoxyacetyl)amino]propanamide Traditional Name: 3-[(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)CCNC(=O)COCC3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O3S/c1-15-6-5-9-17(12-15)20-24-25-21(29-20)23-18(26)10-11-22-19(27)14-28-13-16-7-3-2-4-8-16/h2-9,12H,10-11,13-14H2,1H3,(H,22,27)(H,23,25,26)