2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]ethanamide

Systemtic Name: 2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]ethanamide Openeye Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-benzyloxy-3-methoxy-phenyl)methyl]acetamide CAS Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide IUPAC Name: 2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide Traditional Name: 2-[(4-amino-1,2,4-triazol-3-yl)thio]-N-(4-benzoxy-3-methoxy-benzyl)acetamide Formula: C19H21N5O3S MolecularWeight: 399.46674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC(=O)CSC2=NN=CN2N)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)CNC(=O)CSC2=NN=CN2N)OCC3=CC=CC=C3

InChI

InChI=1S/C19H21N5O3S/c1-26-17-9-15(7-8-16(17)27-11-14-5-3-2-4-6-14)10-21-18(25)12-28-19-23-22-13-24(19)20/h2-9,13H,10-12,20H2,1H3,(H,21,25)