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

Systemtic Name: N-[4-[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]phenyl]pentanamide Openeye Name: N-[4-[[2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]phenyl]pentanamide CAS Name: N-[4-[[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]phenyl]pentanamide IUPAC Name: N-[4-[[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]phenyl]pentanamide Traditional Name: N-[4-[[2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]phenyl]valeramide Formula: C21H25N5O2S2 MolecularWeight: 443.5855

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC)C3=CC=CS3

Isomeric SMILES

CCCCC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC)C3=CC=CS3

InChI

InChI=1S/C21H25N5O2S2/c1-3-5-8-18(27)22-15-9-11-16(12-10-15)23-19(28)14-30-21-25-24-20(26(21)4-2)17-7-6-13-29-17/h6-7,9-13H,3-5,8,14H2,1-2H3,(H,22,27)(H,23,28)