N-[4-[2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]phenyl]butanamide

Systemtic Name: N-[4-[2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]phenyl]butanamide Openeye Name: N-[4-[[2-[[4-ethyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]phenyl]butanamide CAS Name: N-[4-[[2-[[4-ethyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]phenyl]butanamide IUPAC Name: N-[4-[[2-[(4-ethyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]phenyl]butanamide Traditional Name: N-[4-[[2-[[4-ethyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]phenyl]butyramide Formula: C21H24N6O2S MolecularWeight: 424.51926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC)C3=CN=CC=C3

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC)C3=CN=CC=C3

InChI

InChI=1S/C21H24N6O2S/c1-3-6-18(28)23-16-8-10-17(11-9-16)24-19(29)14-30-21-26-25-20(27(21)4-2)15-7-5-12-22-13-15/h5,7-13H,3-4,6,14H2,1-2H3,(H,23,28)(H,24,29)