2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-N-ethyl-propanamide

Systemtic Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-N-ethyl-propanamide Openeye Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-N-ethyl-propanamide CAS Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]thio]-N-cyclohexyl-N-ethylpropanamide IUPAC Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-N-ethylpropanamide Traditional Name: 2-[[4-(3-chlorophenyl)-1,2,4-triazol-3-yl]thio]-N-cyclohexyl-N-ethyl-propionamide Formula: C19H25ClN4OS MolecularWeight: 392.946

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCCC1)C(=O)C(C)SC2=NN=CN2C3=CC(=CC=C3)Cl

Isomeric SMILES

CCN(C1CCCCC1)C(=O)C(C)SC2=NN=CN2C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H25ClN4OS/c1-3-23(16-9-5-4-6-10-16)18(25)14(2)26-19-22-21-13-24(19)17-11-7-8-15(20)12-17/h7-8,11-14,16H,3-6,9-10H2,1-2H3