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

Systemtic Name: N-[(1R)-2-(tert-butylamino)-1-(2-ethoxyphenyl)-2-oxidanylidene-ethyl]-N-cyclopropyl-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[(1R)-2-(tert-butylamino)-1-(2-ethoxyphenyl)-2-oxo-ethyl]-N-cyclopropyl-thiadiazole-4-carboxamide CAS Name: N-[(1R)-2-(tert-butylamino)-1-(2-ethoxyphenyl)-2-oxoethyl]-N-cyclopropyl-4-thiadiazolecarboxamide IUPAC Name: N-[(1R)-2-(tert-butylamino)-1-(2-ethoxyphenyl)-2-oxoethyl]-N-cyclopropylthiadiazole-4-carboxamide Traditional Name: N-[(1R)-2-(tert-butylamino)-2-keto-1-o-phenetyl-ethyl]-N-cyclopropyl-thiadiazole-4-carboxamide Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(C(=O)NC(C)(C)C)N(C2CC2)C(=O)C3=CSN=N3

Isomeric SMILES

CCOC1=CC=CC=C1[C@H](C(=O)NC(C)(C)C)N(C2CC2)C(=O)C3=CSN=N3

InChI

InChI=1S/C20H26N4O3S/c1-5-27-16-9-7-6-8-14(16)17(18(25)21-20(2,3)4)24(13-10-11-13)19(26)15-12-28-23-22-15/h6-9,12-13,17H,5,10-11H2,1-4H3,(H,21,25)/t17-/m1/s1