3-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: 3-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: 3-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: 3-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: 3-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: 3-[(5-cyclohexyl-1-phenyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C17H22N4OS MolecularWeight: 330.44778

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NC(=NN2C3=CC=CC=C3)SCCC(=O)N

Isomeric SMILES

C1CCC(CC1)C2=NC(=NN2C3=CC=CC=C3)SCCC(=O)N

InChI

InChI=1S/C17H22N4OS/c18-15(22)11-12-23-17-19-16(13-7-3-1-4-8-13)21(20-17)14-9-5-2-6-10-14/h2,5-6,9-10,13H,1,3-4,7-8,11-12H2,(H2,18,22)