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

Systemtic Name: N4,N5-bis(cyclopropylmethyl)-3-[(3-methoxyphenyl)sulfanylmethyl]-1,2-oxazole-4,5-dicarboxamide Openeye Name: N4,N5-bis(cyclopropylmethyl)-3-[(3-methoxyphenyl)sulfanylmethyl]isoxazole-4,5-dicarboxamide CAS Name: N4,N5-bis(cyclopropylmethyl)-3-[[(3-methoxyphenyl)thio]methyl]isoxazole-4,5-dicarboxamide IUPAC Name: 4-N,5-N-bis(cyclopropylmethyl)-3-[(3-methoxyphenyl)sulfanylmethyl]-1,2-oxazole-4,5-dicarboxamide Traditional Name: N,N'-bis(cyclopropylmethyl)-3-[[(3-methoxyphenyl)thio]methyl]isoxazole-4,5-dicarboxamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)SCC2=NOC(=C2C(=O)NCC3CC3)C(=O)NCC4CC4

Isomeric SMILES

COC1=CC(=CC=C1)SCC2=NOC(=C2C(=O)NCC3CC3)C(=O)NCC4CC4

InChI

InChI=1S/C21H25N3O4S/c1-27-15-3-2-4-16(9-15)29-12-17-18(20(25)22-10-13-5-6-13)19(28-24-17)21(26)23-11-14-7-8-14/h2-4,9,13-14H,5-8,10-12H2,1H3,(H,22,25)(H,23,26)