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

Systemtic Name: 2-[[5-[(2-chloranylphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-cycloheptyl-propanamide Openeye Name: 2-[[5-[(2-chlorophenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-cycloheptyl-propanamide CAS Name: 2-[[5-[(2-chlorophenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]-N-cycloheptylpropanamide IUPAC Name: 2-[[5-[(2-chlorophenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-cycloheptylpropanamide Traditional Name: 2-[[5-[(2-chlorophenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]-N-cycloheptyl-propionamide Formula: C20H27ClN4O2S MolecularWeight: 422.97198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCCC1)SC2=NN=C(N2C)COC3=CC=CC=C3Cl

Isomeric SMILES

CC(C(=O)NC1CCCCCC1)SC2=NN=C(N2C)COC3=CC=CC=C3Cl

InChI

InChI=1S/C20H27ClN4O2S/c1-14(19(26)22-15-9-5-3-4-6-10-15)28-20-24-23-18(25(20)2)13-27-17-12-8-7-11-16(17)21/h7-8,11-12,14-15H,3-6,9-10,13H2,1-2H3,(H,22,26)