N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-N-(4-propan-2-ylphenyl)-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]-N-(4-propan-2-ylphenyl)-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[2-(benzylamino)-2-oxo-ethyl]-N-(4-isopropylphenyl)thiadiazole-4-carboxamide CAS Name: N-[2-oxo-2-[(phenylmethyl)amino]ethyl]-N-(4-propan-2-ylphenyl)-4-thiadiazolecarboxamide IUPAC Name: N-[2-(benzylamino)-2-oxoethyl]-N-(4-propan-2-ylphenyl)thiadiazole-4-carboxamide Traditional Name: N-[2-(benzylamino)-2-keto-ethyl]-N-p-cumenyl-thiadiazole-4-carboxamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N(CC(=O)NCC2=CC=CC=C2)C(=O)C3=CSN=N3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N(CC(=O)NCC2=CC=CC=C2)C(=O)C3=CSN=N3

InChI

InChI=1S/C21H22N4O2S/c1-15(2)17-8-10-18(11-9-17)25(21(27)19-14-28-24-23-19)13-20(26)22-12-16-6-4-3-5-7-16/h3-11,14-15H,12-13H2,1-2H3,(H,22,26)