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

Systemtic Name: N-[2-(cyclohexylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-N-phenyl-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[2-(cyclohexylamino)-2-oxo-1-(4-pyridyl)ethyl]-N-phenyl-thiadiazole-4-carboxamide CAS Name: N-[2-(cyclohexylamino)-2-oxo-1-pyridin-4-ylethyl]-N-phenyl-4-thiadiazolecarboxamide IUPAC Name: N-[2-(cyclohexylamino)-2-oxo-1-pyridin-4-ylethyl]-N-phenylthiadiazole-4-carboxamide Traditional Name: N-[2-(cyclohexylamino)-2-keto-1-(4-pyridyl)ethyl]-N-phenyl-thiadiazole-4-carboxamide Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C2=CC=NC=C2)N(C3=CC=CC=C3)C(=O)C4=CSN=N4

Isomeric SMILES

C1CCC(CC1)NC(=O)C(C2=CC=NC=C2)N(C3=CC=CC=C3)C(=O)C4=CSN=N4

InChI

InChI=1S/C22H23N5O2S/c28-21(24-17-7-3-1-4-8-17)20(16-11-13-23-14-12-16)27(18-9-5-2-6-10-18)22(29)19-15-30-26-25-19/h2,5-6,9-15,17,20H,1,3-4,7-8H2,(H,24,28)