1-[(6-chloranyl-3-methyl-1-oxidanylidene-3,4-dihydroisochromen-8-yl)sulfonyl]-3-(4,6-dimethoxypyrimidin-2-yl)urea

Systemtic Name: 1-[(6-chloranyl-3-methyl-1-oxidanylidene-3,4-dihydroisochromen-8-yl)sulfonyl]-3-(4,6-dimethoxypyrimidin-2-yl)urea Openeye Name: 1-(6-chloro-3-methyl-1-oxo-isochroman-8-yl)sulfonyl-3-(4,6-dimethoxypyrimidin-2-yl)urea CAS Name: 1-[(6-chloro-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-8-yl)sulfonyl]-3-(4,6-dimethoxy-2-pyrimidinyl)urea IUPAC Name: 1-[(6-chloro-3-methyl-1-oxo-3,4-dihydroisochromen-8-yl)sulfonyl]-3-(4,6-dimethoxypyrimidin-2-yl)urea Traditional Name: 1-(6-chloro-1-keto-3-methyl-isochroman-8-yl)sulfonyl-3-(4,6-dimethoxypyrimidin-2-yl)urea Formula: C17H17ClN4O7S MolecularWeight: 456.85748

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC(=CC(=C2C(=O)O1)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC)Cl

Isomeric SMILES

CC1CC2=CC(=CC(=C2C(=O)O1)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC)Cl

InChI

InChI=1S/C17H17ClN4O7S/c1-8-4-9-5-10(18)6-11(14(9)15(23)29-8)30(25,26)22-17(24)21-16-19-12(27-2)7-13(20-16)28-3/h5-8H,4H2,1-3H3,(H2,19,20,21,22,24)