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

Systemtic Name: N-[2-(cyclohexylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-N-(phenylmethyl)-1,2,5-thiadiazole-3-carboxamide Openeye Name: N-benzyl-N-[2-(cyclohexylamino)-2-oxo-1-(4-pyridyl)ethyl]-1,2,5-thiadiazole-3-carboxamide CAS Name: N-[2-(cyclohexylamino)-2-oxo-1-pyridin-4-ylethyl]-N-(phenylmethyl)-1,2,5-thiadiazole-3-carboxamide IUPAC Name: N-benzyl-N-[2-(cyclohexylamino)-2-oxo-1-pyridin-4-ylethyl]-1,2,5-thiadiazole-3-carboxamide Traditional Name: N-benzyl-N-[2-(cyclohexylamino)-2-keto-1-(4-pyridyl)ethyl]-1,2,5-thiadiazole-3-carboxamide Formula: C23H25N5O2S MolecularWeight: 435.5419

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C2=CC=NC=C2)N(CC3=CC=CC=C3)C(=O)C4=NSN=C4

Isomeric SMILES

C1CCC(CC1)NC(=O)C(C2=CC=NC=C2)N(CC3=CC=CC=C3)C(=O)C4=NSN=C4

InChI

InChI=1S/C23H25N5O2S/c29-22(26-19-9-5-2-6-10-19)21(18-11-13-24-14-12-18)28(16-17-7-3-1-4-8-17)23(30)20-15-25-31-27-20/h1,3-4,7-8,11-15,19,21H,2,5-6,9-10,16H2,(H,26,29)