5-methyl-N-[[5-[(3-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-3-phenyl-1,2-oxazole-4-carboxamide

Systemtic Name: 5-methyl-N-[[5-[(3-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-3-phenyl-1,2-oxazole-4-carboxamide Openeye Name: N-[[4-allyl-5-(m-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-5-methyl-3-phenyl-isoxazole-4-carboxamide CAS Name: 5-methyl-N-[[5-[(3-methylphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-3-phenyl-4-isoxazolecarboxamide IUPAC Name: 5-methyl-N-[[5-[(3-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-3-phenyl-1,2-oxazole-4-carboxamide Traditional Name: N-[[4-allyl-5-[(3-methylbenzyl)thio]-1,2,4-triazol-3-yl]methyl]-5-methyl-3-phenyl-isoxazole-4-carboxamide Formula: C25H25N5O2S MolecularWeight: 459.5633

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NN=C(N2CC=C)CNC(=O)C3=C(ON=C3C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NN=C(N2CC=C)CNC(=O)C3=C(ON=C3C4=CC=CC=C4)C

InChI

InChI=1S/C25H25N5O2S/c1-4-13-30-21(27-28-25(30)33-16-19-10-8-9-17(2)14-19)15-26-24(31)22-18(3)32-29-23(22)20-11-6-5-7-12-20/h4-12,14H,1,13,15-16H2,2-3H3,(H,26,31)