2-(5-chloranyl-3-phenyl-indazol-1-yl)-N-(3-cyclohexylsulfanylpropyl)propanamide

Systemtic Name: 2-(5-chloranyl-3-phenyl-indazol-1-yl)-N-(3-cyclohexylsulfanylpropyl)propanamide Openeye Name: 2-(5-chloro-3-phenyl-indazol-1-yl)-N-(3-cyclohexylsulfanylpropyl)propanamide CAS Name: 2-(5-chloro-3-phenyl-1-indazolyl)-N-[3-(cyclohexylthio)propyl]propanamide IUPAC Name: 2-(5-chloro-3-phenylindazol-1-yl)-N-(3-cyclohexylsulfanylpropyl)propanamide Traditional Name: 2-(5-chloro-3-phenyl-indazol-1-yl)-N-[3-(cyclohexylthio)propyl]propionamide Formula: C25H30ClN3OS MolecularWeight: 456.0432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCCSC1CCCCC1)N2C3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NCCCSC1CCCCC1)N2C3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4

InChI

InChI=1S/C25H30ClN3OS/c1-18(25(30)27-15-8-16-31-21-11-6-3-7-12-21)29-23-14-13-20(26)17-22(23)24(28-29)19-9-4-2-5-10-19/h2,4-5,9-10,13-14,17-18,21H,3,6-8,11-12,15-16H2,1H3,(H,27,30)