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

Systemtic Name: N-[3-(tert-butylamino)-2-(4-methylphenyl)-3-oxidanylidene-1-thiophen-2-yl-propyl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[3-(tert-butylamino)-3-oxo-2-(p-tolyl)-1-(2-thienyl)propyl]thiadiazole-4-carboxamide CAS Name: N-[3-(tert-butylamino)-2-(4-methylphenyl)-3-oxo-1-thiophen-2-ylpropyl]-4-thiadiazolecarboxamide IUPAC Name: N-[3-(tert-butylamino)-2-(4-methylphenyl)-3-oxo-1-thiophen-2-ylpropyl]thiadiazole-4-carboxamide Traditional Name: N-[3-(tert-butylamino)-3-keto-2-(p-tolyl)-1-(2-thienyl)propyl]thiadiazole-4-carboxamide Formula: C21H24N4O2S2 MolecularWeight: 428.57086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(C2=CC=CS2)NC(=O)C3=CSN=N3)C(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(C(C2=CC=CS2)NC(=O)C3=CSN=N3)C(=O)NC(C)(C)C

InChI

InChI=1S/C21H24N4O2S2/c1-13-7-9-14(10-8-13)17(20(27)23-21(2,3)4)18(16-6-5-11-28-16)22-19(26)15-12-29-25-24-15/h5-12,17-18H,1-4H3,(H,22,26)(H,23,27)