N-[3-(tert-butylamino)-1-(furan-2-yl)-3-oxidanylidene-2-phenyl-propyl]-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-[3-(tert-butylamino)-1-(furan-2-yl)-3-oxidanylidene-2-phenyl-propyl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[3-(tert-butylamino)-1-(2-furyl)-3-oxo-2-phenyl-propyl]thiadiazole-4-carboxamide CAS Name: N-[3-(tert-butylamino)-1-(2-furanyl)-3-oxo-2-phenylpropyl]-4-thiadiazolecarboxamide IUPAC Name: N-[3-(tert-butylamino)-1-(furan-2-yl)-3-oxo-2-phenylpropyl]thiadiazole-4-carboxamide Traditional Name: N-[3-(tert-butylamino)-1-(2-furyl)-3-keto-2-phenyl-propyl]thiadiazole-4-carboxamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C(C1=CC=CC=C1)C(C2=CC=CO2)NC(=O)C3=CSN=N3

Isomeric SMILES

CC(C)(C)NC(=O)C(C1=CC=CC=C1)C(C2=CC=CO2)NC(=O)C3=CSN=N3

InChI

InChI=1S/C20H22N4O3S/c1-20(2,3)22-19(26)16(13-8-5-4-6-9-13)17(15-10-7-11-27-15)21-18(25)14-12-28-24-23-14/h4-12,16-17H,1-3H3,(H,21,25)(H,22,26)