6-(4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-6-yl)-2-pentyl-4,5-dihydropyridazin-3-one

Systemtic Name: 6-(4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-6-yl)-2-pentyl-4,5-dihydropyridazin-3-one Openeye Name: 6-(4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-6-yl)-2-pentyl-4,5-dihydropyridazin-3-one CAS Name: 6-(4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-6-yl)-2-pentyl-4,5-dihydropyridazin-3-one IUPAC Name: 6-(4-methylsulfonyl-2,3-dihydro-1,4-benzoxazin-6-yl)-2-pentyl-4,5-dihydropyridazin-3-one Traditional Name: 2-amyl-6-(4-mesyl-2,3-dihydro-1,4-benzoxazin-6-yl)-4,5-dihydropyridazin-3-one Formula: C18H25N3O4S MolecularWeight: 379.4738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)CCC(=N1)C2=CC3=C(C=C2)OCCN3S(=O)(=O)C

Isomeric SMILES

CCCCCN1C(=O)CCC(=N1)C2=CC3=C(C=C2)OCCN3S(=O)(=O)C

InChI

InChI=1S/C18H25N3O4S/c1-3-4-5-10-20-18(22)9-7-15(19-20)14-6-8-17-16(13-14)21(11-12-25-17)26(2,23)24/h6,8,13H,3-5,7,9-12H2,1-2H3