3-[(4-chlorophenyl)sulfanylmethyl]-N4-(2-dimethylaminoethyl)-N5-(phenylmethyl)-1,2-oxazole-4,5-dicarboxamide

Systemtic Name: 3-[(4-chlorophenyl)sulfanylmethyl]-N4-(2-dimethylaminoethyl)-N5-(phenylmethyl)-1,2-oxazole-4,5-dicarboxamide Openeye Name: N5-benzyl-3-[(4-chlorophenyl)sulfanylmethyl]-N4-(2-dimethylaminoethyl)isoxazole-4,5-dicarboxamide CAS Name: 3-[[(4-chlorophenyl)thio]methyl]-N4-(2-dimethylaminoethyl)-N5-(phenylmethyl)isoxazole-4,5-dicarboxamide IUPAC Name: 5-N-benzyl-3-[(4-chlorophenyl)sulfanylmethyl]-4-N-(2-dimethylaminoethyl)-1,2-oxazole-4,5-dicarboxamide Traditional Name: N'-benzyl-3-[[(4-chlorophenyl)thio]methyl]-N-(2-dimethylaminoethyl)isoxazole-4,5-dicarboxamide Formula: C23H25ClN4O3S MolecularWeight: 472.9876

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=C(ON=C1CSC2=CC=C(C=C2)Cl)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CN(C)CCNC(=O)C1=C(ON=C1CSC2=CC=C(C=C2)Cl)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C23H25ClN4O3S/c1-28(2)13-12-25-22(29)20-19(15-32-18-10-8-17(24)9-11-18)27-31-21(20)23(30)26-14-16-6-4-3-5-7-16/h3-11H,12-15H2,1-2H3,(H,25,29)(H,26,30)