N4,N5-bis(cyclopropylmethyl)-3-[(3,5-dimethylphenyl)sulfanylmethyl]-1,2-oxazole-4,5-dicarboxamide

Systemtic Name: N4,N5-bis(cyclopropylmethyl)-3-[(3,5-dimethylphenyl)sulfanylmethyl]-1,2-oxazole-4,5-dicarboxamide Openeye Name: N4,N5-bis(cyclopropylmethyl)-3-[(3,5-dimethylphenyl)sulfanylmethyl]isoxazole-4,5-dicarboxamide CAS Name: N4,N5-bis(cyclopropylmethyl)-3-[[(3,5-dimethylphenyl)thio]methyl]isoxazole-4,5-dicarboxamide IUPAC Name: 4-N,5-N-bis(cyclopropylmethyl)-3-[(3,5-dimethylphenyl)sulfanylmethyl]-1,2-oxazole-4,5-dicarboxamide Traditional Name: N,N'-bis(cyclopropylmethyl)-3-[[(3,5-dimethylphenyl)thio]methyl]isoxazole-4,5-dicarboxamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)SCC2=NOC(=C2C(=O)NCC3CC3)C(=O)NCC4CC4)C

Isomeric SMILES

CC1=CC(=CC(=C1)SCC2=NOC(=C2C(=O)NCC3CC3)C(=O)NCC4CC4)C

InChI

InChI=1S/C22H27N3O3S/c1-13-7-14(2)9-17(8-13)29-12-18-19(21(26)23-10-15-3-4-15)20(28-25-18)22(27)24-11-16-5-6-16/h7-9,15-16H,3-6,10-12H2,1-2H3,(H,23,26)(H,24,27)