N-cyclopropyl-N-[(1S)-1-(3-methoxyphenyl)-2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl]-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-cyclopropyl-N-[(1S)-1-(3-methoxyphenyl)-2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-cyclopropyl-N-[(1S)-2-(1,1-dimethylpropylamino)-1-(3-methoxyphenyl)-2-oxo-ethyl]thiadiazole-4-carboxamide CAS Name: N-cyclopropyl-N-[(1S)-1-(3-methoxyphenyl)-2-(2-methylbutan-2-ylamino)-2-oxoethyl]-4-thiadiazolecarboxamide IUPAC Name: N-cyclopropyl-N-[(1S)-1-(3-methoxyphenyl)-2-(2-methylbutan-2-ylamino)-2-oxoethyl]thiadiazole-4-carboxamide Traditional Name: N-[(1S)-2-(tert-amylamino)-2-keto-1-(3-methoxyphenyl)ethyl]-N-cyclopropyl-thiadiazole-4-carboxamide Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4O3S/c1-5-20(2,3)21-18(25)17(13-7-6-8-15(11-13)27-4)24(14-9-10-14)19(26)16-12-28-23-22-16/h6-8,11-12,14,17H,5,9-10H2,1-4H3,(H,21,25)/t17-/m0/s1