3-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-1-methyl-1-(4-methyl-4-oxidanyl-cyclohexyl)urea

Systemtic Name: 3-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-1-methyl-1-(4-methyl-4-oxidanyl-cyclohexyl)urea Openeye Name: 3-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-1-(4-hydroxy-4-methyl-cyclohexyl)-1-methyl-urea CAS Name: 3-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-1-(4-hydroxy-4-methylcyclohexyl)-1-methylurea IUPAC Name: 3-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-1-(4-hydroxy-4-methylcyclohexyl)-1-methylurea Traditional Name: 3-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-1-(4-hydroxy-4-methyl-cyclohexyl)-1-methyl-urea Formula: C21H29N3O5S MolecularWeight: 435.53706

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(CC1)N(C)C(=O)NC2=NC3=C(C=CC(=C3S2)C4COCCO4)OC)O

Isomeric SMILES

CC1(CCC(CC1)N(C)C(=O)NC2=NC3=C(C=CC(=C3S2)C4COCCO4)OC)O

InChI

InChI=1S/C21H29N3O5S/c1-21(26)8-6-13(7-9-21)24(2)20(25)23-19-22-17-15(27-3)5-4-14(18(17)30-19)16-12-28-10-11-29-16/h4-5,13,16,26H,6-12H2,1-3H3,(H,22,23,25)