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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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