N-[(1S)-2-(tert-butylamino)-1-(4-ethylphenyl)-2-oxidanylidene-ethyl]-N-cyclopropyl-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-[(1S)-2-(tert-butylamino)-1-(4-ethylphenyl)-2-oxidanylidene-ethyl]-N-cyclopropyl-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[(1S)-2-(tert-butylamino)-1-(4-ethylphenyl)-2-oxo-ethyl]-N-cyclopropyl-thiadiazole-4-carboxamide CAS Name: N-[(1S)-2-(tert-butylamino)-1-(4-ethylphenyl)-2-oxoethyl]-N-cyclopropyl-4-thiadiazolecarboxamide IUPAC Name: N-[(1S)-2-(tert-butylamino)-1-(4-ethylphenyl)-2-oxoethyl]-N-cyclopropylthiadiazole-4-carboxamide Traditional Name: N-[(1S)-2-(tert-butylamino)-1-(4-ethylphenyl)-2-keto-ethyl]-N-cyclopropyl-thiadiazole-4-carboxamide Formula: C20H26N4O2S MolecularWeight: 386.51104

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C(=O)NC(C)(C)C)N(C2CC2)C(=O)C3=CSN=N3

Isomeric SMILES

CCC1=CC=C(C=C1)[C@@H](C(=O)NC(C)(C)C)N(C2CC2)C(=O)C3=CSN=N3

InChI

InChI=1S/C20H26N4O2S/c1-5-13-6-8-14(9-7-13)17(18(25)21-20(2,3)4)24(15-10-11-15)19(26)16-12-27-23-22-16/h6-9,12,15,17H,5,10-11H2,1-4H3,(H,21,25)/t17-/m0/s1