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

Systemtic Name: N-[(1R)-2-(tert-butylamino)-1-(4-ethylphenyl)-2-oxidanylidene-ethyl]-N-cyclopentyl-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[(1R)-2-(tert-butylamino)-1-(4-ethylphenyl)-2-oxo-ethyl]-N-cyclopentyl-thiadiazole-4-carboxamide CAS Name: N-[(1R)-2-(tert-butylamino)-1-(4-ethylphenyl)-2-oxoethyl]-N-cyclopentyl-4-thiadiazolecarboxamide IUPAC Name: N-[(1R)-2-(tert-butylamino)-1-(4-ethylphenyl)-2-oxoethyl]-N-cyclopentylthiadiazole-4-carboxamide Traditional Name: N-[(1R)-2-(tert-butylamino)-1-(4-ethylphenyl)-2-keto-ethyl]-N-cyclopentyl-thiadiazole-4-carboxamide Formula: C22H30N4O2S MolecularWeight: 414.5642

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C(=O)NC(C)(C)C)N(C2CCCC2)C(=O)C3=CSN=N3

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C(=O)NC(C)(C)C)N(C2CCCC2)C(=O)C3=CSN=N3

InChI

InChI=1S/C22H30N4O2S/c1-5-15-10-12-16(13-11-15)19(20(27)23-22(2,3)4)26(17-8-6-7-9-17)21(28)18-14-29-25-24-18/h10-14,17,19H,5-9H2,1-4H3,(H,23,27)/t19-/m1/s1