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

Systemtic Name: N4,N5-bis(2-dimethylaminoethyl)-3-[(4-fluorophenyl)sulfanylmethyl]-1,2-oxazole-4,5-dicarboxamide Openeye Name: N4,N5-bis(2-dimethylaminoethyl)-3-[(4-fluorophenyl)sulfanylmethyl]isoxazole-4,5-dicarboxamide CAS Name: N4,N5-bis(2-dimethylaminoethyl)-3-[[(4-fluorophenyl)thio]methyl]isoxazole-4,5-dicarboxamide IUPAC Name: 4-N,5-N-bis(2-dimethylaminoethyl)-3-[(4-fluorophenyl)sulfanylmethyl]-1,2-oxazole-4,5-dicarboxamide Traditional Name: N,N'-bis(2-dimethylaminoethyl)-3-[[(4-fluorophenyl)thio]methyl]isoxazole-4,5-dicarboxamide Formula: C20H28FN5O3S MolecularWeight: 437.531423

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=C(ON=C1CSC2=CC=C(C=C2)F)C(=O)NCCN(C)C

Isomeric SMILES

CN(C)CCNC(=O)C1=C(ON=C1CSC2=CC=C(C=C2)F)C(=O)NCCN(C)C

InChI

InChI=1S/C20H28FN5O3S/c1-25(2)11-9-22-19(27)17-16(13-30-15-7-5-14(21)6-8-15)24-29-18(17)20(28)23-10-12-26(3)4/h5-8H,9-13H2,1-4H3,(H,22,27)(H,23,28)