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

Systemtic Name: N-[4-[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-3-methyl-phenyl]propanamide Openeye Name: N-[4-[[2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-3-methyl-phenyl]propanamide CAS Name: N-[4-[[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]-3-methylphenyl]propanamide IUPAC Name: N-[4-[[2-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-3-methylphenyl]propanamide Traditional Name: N-[4-[[2-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]-3-methyl-phenyl]propionamide Formula: C20H23N5O2S2 MolecularWeight: 429.55892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N5O2S2/c1-4-17(26)21-14-8-9-15(13(3)11-14)22-18(27)12-29-20-24-23-19(25(20)5-2)16-7-6-10-28-16/h6-11H,4-5,12H2,1-3H3,(H,21,26)(H,22,27)