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

Systemtic Name: 2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N,N-bis(phenylmethyl)propanamide Openeye Name: N,N-dibenzyl-2-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: 2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-N,N-bis(phenylmethyl)propanamide IUPAC Name: N,N-dibenzyl-2-[(4-methyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N,N-dibenzyl-2-[[4-methyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C25H25N5OS MolecularWeight: 443.5639

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(CC1=CC=CC=C1)CC2=CC=CC=C2)SC3=NN=C(N3C)C4=CC=NC=C4

Isomeric SMILES

CC(C(=O)N(CC1=CC=CC=C1)CC2=CC=CC=C2)SC3=NN=C(N3C)C4=CC=NC=C4

InChI

InChI=1S/C25H25N5OS/c1-19(32-25-28-27-23(29(25)2)22-13-15-26-16-14-22)24(31)30(17-20-9-5-3-6-10-20)18-21-11-7-4-8-12-21/h3-16,19H,17-18H2,1-2H3