2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-methylphenyl)-thiophen-2-yl-methyl]ethanamide

Systemtic Name: 2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-methylphenyl)-thiophen-2-yl-methyl]ethanamide Openeye Name: 2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[p-tolyl(2-thienyl)methyl]acetamide CAS Name: 2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-[(4-methylphenyl)-thiophen-2-ylmethyl]acetamide IUPAC Name: 2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-methylphenyl)-thiophen-2-ylmethyl]acetamide Traditional Name: 2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-[p-tolyl(2-thienyl)methyl]acetamide Formula: C25H24N4OS2 MolecularWeight: 460.61426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CSC3=NN=C(N3C4=CC=CC=C4)C5CC5

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CSC3=NN=C(N3C4=CC=CC=C4)C5CC5

InChI

InChI=1S/C25H24N4OS2/c1-17-9-11-18(12-10-17)23(21-8-5-15-31-21)26-22(30)16-32-25-28-27-24(19-13-14-19)29(25)20-6-3-2-4-7-20/h2-12,15,19,23H,13-14,16H2,1H3,(H,26,30)