N-[5-[2-(4-ethylpiperazin-1-yl)ethylcarbamoyl]-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide

Systemtic Name: N-[5-[2-(4-ethylpiperazin-1-yl)ethylcarbamoyl]-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[5-[2-(4-ethylpiperazin-1-yl)ethylcarbamoyl]-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[5-[[2-(4-ethyl-1-piperazinyl)ethylamino]-oxomethyl]-2-methylphenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[5-[2-(4-ethylpiperazin-1-yl)ethylcarbamoyl]-2-methylphenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[5-[2-(4-ethylpiperazino)ethylcarbamoyl]-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C21H30N4O3S MolecularWeight: 418.5529

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCNC(=O)C2=CC(=C(C=C2)C)NC(=O)C3=CSCCO3

Isomeric SMILES

CCN1CCN(CC1)CCNC(=O)C2=CC(=C(C=C2)C)NC(=O)C3=CSCCO3

InChI

InChI=1S/C21H30N4O3S/c1-3-24-8-10-25(11-9-24)7-6-22-20(26)17-5-4-16(2)18(14-17)23-21(27)19-15-29-13-12-28-19/h4-5,14-15H,3,6-13H2,1-2H3,(H,22,26)(H,23,27)