N-[(1R)-2-(tert-butylamino)-1-(4-ethylphenyl)-2-oxidanylidene-ethyl]-N-prop-2-enyl-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-[(1R)-2-(tert-butylamino)-1-(4-ethylphenyl)-2-oxidanylidene-ethyl]-N-prop-2-enyl-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-allyl-N-[(1R)-2-(tert-butylamino)-1-(4-ethylphenyl)-2-oxo-ethyl]thiadiazole-4-carboxamide CAS Name: N-[(1R)-2-(tert-butylamino)-1-(4-ethylphenyl)-2-oxoethyl]-N-prop-2-enyl-4-thiadiazolecarboxamide IUPAC Name: N-[(1R)-2-(tert-butylamino)-1-(4-ethylphenyl)-2-oxoethyl]-N-prop-2-enylthiadiazole-4-carboxamide Traditional Name: N-allyl-N-[(1R)-2-(tert-butylamino)-1-(4-ethylphenyl)-2-keto-ethyl]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(CC=C)C(=O)C2=CSN=N2

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C(=O)NC(C)(C)C)N(CC=C)C(=O)C2=CSN=N2

InChI

InChI=1S/C20H26N4O2S/c1-6-12-24(19(26)16-13-27-23-22-16)17(18(25)21-20(3,4)5)15-10-8-14(7-2)9-11-15/h6,8-11,13,17H,1,7,12H2,2-5H3,(H,21,25)/t17-/m1/s1