4-ethanoyl-N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-1-methyl-3,5-bis(oxidanylidene)cyclohexane-1-carboxamide

Systemtic Name: 4-ethanoyl-N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-1-methyl-3,5-bis(oxidanylidene)cyclohexane-1-carboxamide Openeye Name: 4-acetyl-N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-1-methyl-3,5-dioxo-cyclohexanecarboxamide CAS Name: 4-acetyl-N-[2-[(2-methoxyphenyl)methylthio]-1,3-benzothiazol-6-yl]-1-methyl-3,5-dioxo-1-cyclohexanecarboxamide IUPAC Name: 4-acetyl-N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-1-methyl-3,5-dioxocyclohexane-1-carboxamide Traditional Name: 4-acetyl-3,5-diketo-1-methyl-N-[2-(o-anisylthio)-1,3-benzothiazol-6-yl]cyclohexanecarboxamide Formula: C25H24N2O5S2 MolecularWeight: 496.59846

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(=O)CC(CC1=O)(C)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC4=CC=CC=C4OC

Isomeric SMILES

CC(=O)C1C(=O)CC(CC1=O)(C)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC4=CC=CC=C4OC

InChI

InChI=1S/C25H24N2O5S2/c1-14(28)22-18(29)11-25(2,12-19(22)30)23(31)26-16-8-9-17-21(10-16)34-24(27-17)33-13-15-6-4-5-7-20(15)32-3/h4-10,22H,11-13H2,1-3H3,(H,26,31)