2-azanyl-2-methyl-N-[1-[4-methyl-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-2-phenylmethoxy-ethyl]propanamide

Systemtic Name: 2-azanyl-2-methyl-N-[1-[4-methyl-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-2-phenylmethoxy-ethyl]propanamide Openeye Name: 2-amino-N-[2-benzyloxy-1-[4-methyl-5-(o-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]ethyl]-2-methyl-propanamide CAS Name: 2-amino-2-methyl-N-[1-[4-methyl-5-[(2-methylphenyl)methylthio]-1,2,4-triazol-3-yl]-2-phenylmethoxyethyl]propanamide IUPAC Name: 2-amino-2-methyl-N-[1-[4-methyl-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-2-phenylmethoxyethyl]propanamide Traditional Name: 2-amino-N-[2-benzoxy-1-[4-methyl-5-[(2-methylbenzyl)thio]-1,2,4-triazol-3-yl]ethyl]-2-methyl-propionamide Formula: C24H31N5O2S MolecularWeight: 453.60024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NN=C(N2C)C(COCC3=CC=CC=C3)NC(=O)C(C)(C)N

Isomeric SMILES

CC1=CC=CC=C1CSC2=NN=C(N2C)C(COCC3=CC=CC=C3)NC(=O)C(C)(C)N

InChI

InChI=1S/C24H31N5O2S/c1-17-10-8-9-13-19(17)16-32-23-28-27-21(29(23)4)20(26-22(30)24(2,3)25)15-31-14-18-11-6-5-7-12-18/h5-13,20H,14-16,25H2,1-4H3,(H,26,30)