4-[[(2R)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]amino]benzamide

Systemtic Name: 4-[[(2R)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]amino]benzamide Openeye Name: 4-[[(2R)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]amino]benzamide CAS Name: 4-[[(2R)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]-1-oxopropyl]amino]benzamide IUPAC Name: 4-[[(2R)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanoyl]amino]benzamide Traditional Name: 4-[[(2R)-2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]propanoyl]amino]benzamide Formula: C19H19N5O2S MolecularWeight: 381.45146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)N)SC2=NN=C(N2C)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)C(=O)N)SC2=NN=C(N2C)C3=CC=CC=C3

InChI

InChI=1S/C19H19N5O2S/c1-12(18(26)21-15-10-8-13(9-11-15)16(20)25)27-19-23-22-17(24(19)2)14-6-4-3-5-7-14/h3-12H,1-2H3,(H2,20,25)(H,21,26)/t12-/m1/s1