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

Systemtic Name: N-[2-methyl-5-(4-methylpiperazin-1-yl)carbonyl-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[2-methyl-5-(4-methylpiperazine-1-carbonyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[2-methyl-5-[(4-methyl-1-piperazinyl)-oxomethyl]phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[2-methyl-5-(4-methylpiperazine-1-carbonyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[2-methyl-5-(4-methylpiperazine-1-carbonyl)phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C18H23N3O3S MolecularWeight: 361.45852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C)NC(=O)C3=CSCCO3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C)NC(=O)C3=CSCCO3

InChI

InChI=1S/C18H23N3O3S/c1-13-3-4-14(18(23)21-7-5-20(2)6-8-21)11-15(13)19-17(22)16-12-25-10-9-24-16/h3-4,11-12H,5-10H2,1-2H3,(H,19,22)