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

Systemtic Name: N-[(1R)-2-(tert-butylamino)-1-(3-methylphenyl)-2-oxidanylidene-ethyl]-N-cyclopropyl-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[(1R)-2-(tert-butylamino)-1-(m-tolyl)-2-oxo-ethyl]-N-cyclopropyl-thiadiazole-4-carboxamide CAS Name: N-[(1R)-2-(tert-butylamino)-1-(3-methylphenyl)-2-oxoethyl]-N-cyclopropyl-4-thiadiazolecarboxamide IUPAC Name: N-[(1R)-2-(tert-butylamino)-1-(3-methylphenyl)-2-oxoethyl]-N-cyclopropylthiadiazole-4-carboxamide Traditional Name: N-[(1R)-2-(tert-butylamino)-2-keto-1-(m-tolyl)ethyl]-N-cyclopropyl-thiadiazole-4-carboxamide Formula: C19H24N4O2S MolecularWeight: 372.48446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C(=O)NC(C)(C)C)N(C2CC2)C(=O)C3=CSN=N3

Isomeric SMILES

CC1=CC(=CC=C1)[C@H](C(=O)NC(C)(C)C)N(C2CC2)C(=O)C3=CSN=N3

InChI

InChI=1S/C19H24N4O2S/c1-12-6-5-7-13(10-12)16(17(24)20-19(2,3)4)23(14-8-9-14)18(25)15-11-26-22-21-15/h5-7,10-11,14,16H,8-9H2,1-4H3,(H,20,24)/t16-/m1/s1