N-(cyclohexylmethyl)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(cyclohexylmethyl)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(cyclohexylmethyl)-2-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(cyclohexylmethyl)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(cyclohexylmethyl)-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(cyclohexylmethyl)-2-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C18H25N5OS MolecularWeight: 359.489

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1CCCCC1)SC2=NN=C(N2C)C3=CC=NC=C3

Isomeric SMILES

CC(C(=O)NCC1CCCCC1)SC2=NN=C(N2C)C3=CC=NC=C3

InChI

InChI=1S/C18H25N5OS/c1-13(17(24)20-12-14-6-4-3-5-7-14)25-18-22-21-16(23(18)2)15-8-10-19-11-9-15/h8-11,13-14H,3-7,12H2,1-2H3,(H,20,24)