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

Systemtic Name: N-[(1S)-2-(tert-butylamino)-1-(4-dimethylaminophenyl)-2-oxidanylidene-ethyl]-N-cyclopropyl-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[(1S)-2-(tert-butylamino)-1-(4-dimethylaminophenyl)-2-oxo-ethyl]-N-cyclopropyl-thiadiazole-4-carboxamide CAS Name: N-[(1S)-2-(tert-butylamino)-1-(4-dimethylaminophenyl)-2-oxoethyl]-N-cyclopropyl-4-thiadiazolecarboxamide IUPAC Name: N-[(1S)-2-(tert-butylamino)-1-(4-dimethylaminophenyl)-2-oxoethyl]-N-cyclopropylthiadiazole-4-carboxamide Traditional Name: N-[(1S)-2-(tert-butylamino)-1-(4-dimethylaminophenyl)-2-keto-ethyl]-N-cyclopropyl-thiadiazole-4-carboxamide Formula: C20H27N5O2S MolecularWeight: 401.52568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27N5O2S/c1-20(2,3)21-18(26)17(13-6-8-14(9-7-13)24(4)5)25(15-10-11-15)19(27)16-12-28-23-22-16/h6-9,12,15,17H,10-11H2,1-5H3,(H,21,26)/t17-/m0/s1