N-[(1S)-2-(tert-butylamino)-1-(furan-2-yl)-2-oxidanylidene-ethyl]-N-phenethyl-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-[(1S)-2-(tert-butylamino)-1-(furan-2-yl)-2-oxidanylidene-ethyl]-N-phenethyl-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[(1S)-2-(tert-butylamino)-1-(2-furyl)-2-oxo-ethyl]-N-phenethyl-thiadiazole-4-carboxamide CAS Name: N-[(1S)-2-(tert-butylamino)-1-(2-furanyl)-2-oxoethyl]-N-phenethyl-4-thiadiazolecarboxamide IUPAC Name: N-[(1S)-2-(tert-butylamino)-1-(furan-2-yl)-2-oxoethyl]-N-phenethylthiadiazole-4-carboxamide Traditional Name: N-[(1S)-2-(tert-butylamino)-1-(2-furyl)-2-keto-ethyl]-N-phenethyl-thiadiazole-4-carboxamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C(C1=CC=CO1)N(CCC2=CC=CC=C2)C(=O)C3=CSN=N3

Isomeric SMILES

CC(C)(C)NC(=O)[C@H](C1=CC=CO1)N(CCC2=CC=CC=C2)C(=O)C3=CSN=N3

InChI

InChI=1S/C21H24N4O3S/c1-21(2,3)22-19(26)18(17-10-7-13-28-17)25(20(27)16-14-29-24-23-16)12-11-15-8-5-4-6-9-15/h4-10,13-14,18H,11-12H2,1-3H3,(H,22,26)/t18-/m0/s1