N-[(1S)-2-(cyclohexylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-N-(2-methylphenyl)-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-[(1S)-2-(cyclohexylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-N-(2-methylphenyl)-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[(1S)-2-(cyclohexylamino)-2-oxo-1-(4-pyridyl)ethyl]-N-(o-tolyl)thiadiazole-4-carboxamide CAS Name: N-[(1S)-2-(cyclohexylamino)-2-oxo-1-pyridin-4-ylethyl]-N-(2-methylphenyl)-4-thiadiazolecarboxamide IUPAC Name: N-[(1S)-2-(cyclohexylamino)-2-oxo-1-pyridin-4-ylethyl]-N-(2-methylphenyl)thiadiazole-4-carboxamide Traditional Name: N-[(1S)-2-(cyclohexylamino)-2-keto-1-(4-pyridyl)ethyl]-N-(o-tolyl)thiadiazole-4-carboxamide Formula: C23H25N5O2S MolecularWeight: 435.5419

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(C(C2=CC=NC=C2)C(=O)NC3CCCCC3)C(=O)C4=CSN=N4

Isomeric SMILES

CC1=CC=CC=C1N([C@@H](C2=CC=NC=C2)C(=O)NC3CCCCC3)C(=O)C4=CSN=N4

InChI

InChI=1S/C23H25N5O2S/c1-16-7-5-6-10-20(16)28(23(30)19-15-31-27-26-19)21(17-11-13-24-14-12-17)22(29)25-18-8-3-2-4-9-18/h5-7,10-15,18,21H,2-4,8-9H2,1H3,(H,25,29)/t21-/m0/s1