1-oxidanylidene-N-(2-phenylbutyl)-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxamide

Systemtic Name: 1-oxidanylidene-N-(2-phenylbutyl)-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxamide Openeye Name: 1-oxo-N-(2-phenylbutyl)-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxamide CAS Name: 1-oxo-N-(2-phenylbutyl)-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxamide IUPAC Name: 1-oxo-N-(2-phenylbutyl)-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxamide Traditional Name: 1-keto-N-(2-phenylbutyl)-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazole-3a-carboxamide Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C12CCC(=O)N1C3=CC=CC=C3S2)C4=CC=CC=C4

Isomeric SMILES

CCC(CNC(=O)C12CCC(=O)N1C3=CC=CC=C3S2)C4=CC=CC=C4

InChI

InChI=1S/C21H22N2O2S/c1-2-15(16-8-4-3-5-9-16)14-22-20(25)21-13-12-19(24)23(21)17-10-6-7-11-18(17)26-21/h3-11,15H,2,12-14H2,1H3,(H,22,25)