N4,N5-bis(2-dimethylaminoethyl)-3-(pyridin-4-ylsulfanylmethyl)-1,2-oxazole-4,5-dicarboxamide

Systemtic Name: N4,N5-bis(2-dimethylaminoethyl)-3-(pyridin-4-ylsulfanylmethyl)-1,2-oxazole-4,5-dicarboxamide Openeye Name: N4,N5-bis(2-dimethylaminoethyl)-3-(4-pyridylsulfanylmethyl)isoxazole-4,5-dicarboxamide CAS Name: N4,N5-bis(2-dimethylaminoethyl)-3-[(pyridin-4-ylthio)methyl]isoxazole-4,5-dicarboxamide IUPAC Name: 4-N,5-N-bis(2-dimethylaminoethyl)-3-(pyridin-4-ylsulfanylmethyl)-1,2-oxazole-4,5-dicarboxamide Traditional Name: N,N'-bis(2-dimethylaminoethyl)-3-[(4-pyridylthio)methyl]isoxazole-4,5-dicarboxamide Formula: C19H28N6O3S MolecularWeight: 420.52902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H28N6O3S/c1-24(2)11-9-21-18(26)16-15(13-29-14-5-7-20-8-6-14)23-28-17(16)19(27)22-10-12-25(3)4/h5-8H,9-13H2,1-4H3,(H,21,26)(H,22,27)