N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-3-oxidanylidene-1,2-dihydroindene-1-carboxamide

Systemtic Name: N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-3-oxidanylidene-1,2-dihydroindene-1-carboxamide Openeye Name: N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-3-oxo-indane-1-carboxamide CAS Name: N-[2-[(2-methoxyphenyl)methylthio]-1,3-benzothiazol-6-yl]-3-oxo-1,2-dihydroindene-1-carboxamide IUPAC Name: N-[2-[(2-methoxyphenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-3-oxo-1,2-dihydroindene-1-carboxamide Traditional Name: 3-keto-N-[2-(o-anisylthio)-1,3-benzothiazol-6-yl]indane-1-carboxamide Formula: C25H20N2O3S2 MolecularWeight: 460.5679

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4CC(=O)C5=CC=CC=C45

Isomeric SMILES

COC1=CC=CC=C1CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C4CC(=O)C5=CC=CC=C45

InChI

InChI=1S/C25H20N2O3S2/c1-30-22-9-5-2-6-15(22)14-31-25-27-20-11-10-16(12-23(20)32-25)26-24(29)19-13-21(28)18-8-4-3-7-17(18)19/h2-12,19H,13-14H2,1H3,(H,26,29)