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

Systemtic Name: 2-(1,3-benzodioxol-5-ylcarbonylamino)-N-(3-methylsulfanylphenyl)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide Openeye Name: 2-(1,3-benzodioxole-5-carbonylamino)-N-(3-methylsulfanylphenyl)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-N-[3-(methylthio)phenyl]-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide IUPAC Name: 2-(1,3-benzodioxole-5-carbonylamino)-N-(3-methylsulfanylphenyl)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide Traditional Name: N-[3-(methylthio)phenyl]-2-(piperonyloylamino)-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxamide Formula: C23H21N3O4S2 MolecularWeight: 467.56054

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)C2CCCC3=C2N=C(S3)NC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)C2CCCC3=C2N=C(S3)NC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H21N3O4S2/c1-31-15-5-2-4-14(11-15)24-22(28)16-6-3-7-19-20(16)25-23(32-19)26-21(27)13-8-9-17-18(10-13)30-12-29-17/h2,4-5,8-11,16H,3,6-7,12H2,1H3,(H,24,28)(H,25,26,27)