2-(1,3-benzodioxol-5-ylcarbonylamino)-N-(4-phenoxyphenyl)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-ylcarbonylamino)-N-(4-phenoxyphenyl)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide Openeye Name: 2-(1,3-benzodioxole-5-carbonylamino)-N-(4-phenoxyphenyl)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-N-(4-phenoxyphenyl)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide IUPAC Name: 2-(1,3-benzodioxole-5-carbonylamino)-N-(4-phenoxyphenyl)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide Traditional Name: N-(4-phenoxyphenyl)-2-(piperonyloylamino)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide Formula: C28H23N3O5S MolecularWeight: 513.56432

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)SC(=N2)NC(=O)C3=CC4=C(C=C3)OCO4)C(=O)NC5=CC=C(C=C5)OC6=CC=CC=C6

Isomeric SMILES

C1CC(C2=C(C1)SC(=N2)NC(=O)C3=CC4=C(C=C3)OCO4)C(=O)NC5=CC=C(C=C5)OC6=CC=CC=C6

InChI

InChI=1S/C28H23N3O5S/c32-26(17-9-14-22-23(15-17)35-16-34-22)31-28-30-25-21(7-4-8-24(25)37-28)27(33)29-18-10-12-20(13-11-18)36-19-5-2-1-3-6-19/h1-3,5-6,9-15,21H,4,7-8,16H2,(H,29,33)(H,30,31,32)