N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-1-oxidanylidene-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxamide

Systemtic Name: N-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-1-oxidanylidene-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxamide Openeye Name: N-[(4-benzyloxy-3-methoxy-phenyl)methyl]-1-oxo-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxamide CAS Name: N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-1-oxo-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxamide IUPAC Name: N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-1-oxo-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxamide Traditional Name: N-(4-benzoxy-3-methoxy-benzyl)-1-keto-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxamide Formula: C26H24N2O4S MolecularWeight: 460.54476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNC(=O)C23CCC(=O)N2C4=CC=CC=C4S3)OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)CNC(=O)C23CCC(=O)N2C4=CC=CC=C4S3)OCC5=CC=CC=C5

InChI

InChI=1S/C26H24N2O4S/c1-31-22-15-19(11-12-21(22)32-17-18-7-3-2-4-8-18)16-27-25(30)26-14-13-24(29)28(26)20-9-5-6-10-23(20)33-26/h2-12,15H,13-14,16-17H2,1H3,(H,27,30)