N-[(1S)-2-(cyclohexylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-N-(4-methoxyphenyl)-1,2,5-thiadiazole-3-carboxamide

Systemtic Name: N-[(1S)-2-(cyclohexylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-N-(4-methoxyphenyl)-1,2,5-thiadiazole-3-carboxamide Openeye Name: N-[(1S)-2-(cyclohexylamino)-2-oxo-1-(4-pyridyl)ethyl]-N-(4-methoxyphenyl)-1,2,5-thiadiazole-3-carboxamide CAS Name: N-[(1S)-2-(cyclohexylamino)-2-oxo-1-pyridin-4-ylethyl]-N-(4-methoxyphenyl)-1,2,5-thiadiazole-3-carboxamide IUPAC Name: N-[(1S)-2-(cyclohexylamino)-2-oxo-1-pyridin-4-ylethyl]-N-(4-methoxyphenyl)-1,2,5-thiadiazole-3-carboxamide Traditional Name: N-[(1S)-2-(cyclohexylamino)-2-keto-1-(4-pyridyl)ethyl]-N-(4-methoxyphenyl)-1,2,5-thiadiazole-3-carboxamide Formula: C23H25N5O3S MolecularWeight: 451.5413

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(C(C2=CC=NC=C2)C(=O)NC3CCCCC3)C(=O)C4=NSN=C4

Isomeric SMILES

COC1=CC=C(C=C1)N([C@@H](C2=CC=NC=C2)C(=O)NC3CCCCC3)C(=O)C4=NSN=C4

InChI

InChI=1S/C23H25N5O3S/c1-31-19-9-7-18(8-10-19)28(23(30)20-15-25-32-27-20)21(16-11-13-24-14-12-16)22(29)26-17-5-3-2-4-6-17/h7-15,17,21H,2-6H2,1H3,(H,26,29)/t21-/m0/s1