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

Systemtic Name: N-[5-[2-(1H-imidazol-5-yl)ethylcarbamoyl]-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[5-[2-(1H-imidazol-5-yl)ethylcarbamoyl]-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[5-[[2-(1H-imidazol-5-yl)ethylamino]-oxomethyl]-2-methylphenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[5-[2-(1H-imidazol-5-yl)ethylcarbamoyl]-2-methylphenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[5-[2-(1H-imidazol-5-yl)ethylcarbamoyl]-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCC2=CN=CN2)NC(=O)C3=CSCCO3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCC2=CN=CN2)NC(=O)C3=CSCCO3

InChI

InChI=1S/C18H20N4O3S/c1-12-2-3-13(17(23)20-5-4-14-9-19-11-21-14)8-15(12)22-18(24)16-10-26-7-6-25-16/h2-3,8-11H,4-7H2,1H3,(H,19,21)(H,20,23)(H,22,24)