3-[2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl-phenyl-amino]propanamide

Systemtic Name: 3-[2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl-phenyl-amino]propanamide Openeye Name: 3-(N-[2-[[5-(m-tolyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]anilino)propanamide CAS Name: 3-(N-[2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]thio]-1-oxoethyl]anilino)propanamide IUPAC Name: 3-(N-[2-[[5-(3-methylphenyl)-4-propyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]anilino)propanamide Traditional Name: 3-(N-[2-[[5-(m-tolyl)-4-propyl-1,2,4-triazol-3-yl]thio]acetyl]anilino)propionamide Formula: C23H27N5O2S MolecularWeight: 437.55778

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC(=O)N(CCC(=O)N)C2=CC=CC=C2)C3=CC(=CC=C3)C

Isomeric SMILES

CCCN1C(=NN=C1SCC(=O)N(CCC(=O)N)C2=CC=CC=C2)C3=CC(=CC=C3)C

InChI

InChI=1S/C23H27N5O2S/c1-3-13-28-22(18-9-7-8-17(2)15-18)25-26-23(28)31-16-21(30)27(14-12-20(24)29)19-10-5-4-6-11-19/h4-11,15H,3,12-14,16H2,1-2H3,(H2,24,29)