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

Systemtic Name: 2-benzamido-N-(1,3-benzodioxol-5-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide Openeye Name: 2-benzamido-N-(1,3-benzodioxol-5-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide CAS Name: 2-benzamido-N-(1,3-benzodioxol-5-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide IUPAC Name: 2-benzamido-N-(1,3-benzodioxol-5-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide Traditional Name: 2-benzamido-N-(1,3-benzodioxol-5-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)SC(=N2)NC(=O)C3=CC=CC=C3)C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC(C2=C(C1)SC(=N2)NC(=O)C3=CC=CC=C3)C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H19N3O4S/c26-20(13-5-2-1-3-6-13)25-22-24-19-15(7-4-8-18(19)30-22)21(27)23-14-9-10-16-17(11-14)29-12-28-16/h1-3,5-6,9-11,15H,4,7-8,12H2,(H,23,27)(H,24,25,26)