4-[2-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanoylamino]benzamide

Systemtic Name: 4-[2-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanoylamino]benzamide Openeye Name: 4-[2-[[5-(2-furyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanoylamino]benzamide CAS Name: 4-[[2-[[5-(2-furanyl)-4-methyl-1,2,4-triazol-3-yl]thio]-1-oxopropyl]amino]benzamide IUPAC Name: 4-[2-[[5-(furan-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanoylamino]benzamide Traditional Name: 4-[2-[[5-(2-furyl)-4-methyl-1,2,4-triazol-3-yl]thio]propanoylamino]benzamide Formula: C17H17N5O3S MolecularWeight: 371.41358

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=CO3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(=O)N)SC2=NN=C(N2C)C3=CC=CO3

InChI

InChI=1S/C17H17N5O3S/c1-10(16(24)19-12-7-5-11(6-8-12)14(18)23)26-17-21-20-15(22(17)2)13-4-3-9-25-13/h3-10H,1-2H3,(H2,18,23)(H,19,24)