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

Systemtic Name: N-[4-methyl-3-[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]phenyl]pentanamide Openeye Name: N-[4-methyl-3-[[2-[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]phenyl]pentanamide CAS Name: N-[4-methyl-3-[[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]phenyl]pentanamide IUPAC Name: N-[4-methyl-3-[[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]phenyl]pentanamide Traditional Name: N-[4-methyl-3-[[2-[[4-methyl-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)C)NC(=O)CSC2=NN=C(N2C)C3=CC=CS3

Isomeric SMILES

CCCCC(=O)NC1=CC(=C(C=C1)C)NC(=O)CSC2=NN=C(N2C)C3=CC=CS3

InChI

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