N-[1-[2-(1,3-benzodioxol-5-ylcarbonyl)hydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-methoxy-benzamide

Systemtic Name: N-[1-[2-(1,3-benzodioxol-5-ylcarbonyl)hydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-methoxy-benzamide Openeye Name: N-[1-[(1,3-benzodioxole-5-carbonylamino)carbamoyl]-3-methylsulfanyl-propyl]-2-methoxy-benzamide CAS Name: N-[1-[[1,3-benzodioxol-5-yl(oxo)methyl]hydrazo]-4-(methylthio)-1-oxobutan-2-yl]-2-methoxybenzamide IUPAC Name: N-[1-[2-(1,3-benzodioxole-5-carbonyl)hydrazinyl]-4-methylsulfanyl-1-oxobutan-2-yl]-2-methoxybenzamide Traditional Name: 2-methoxy-N-[3-(methylthio)-1-[(piperonyloylamino)carbamoyl]propyl]benzamide Formula: C21H23N3O6S MolecularWeight: 445.48882

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NNC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC(CCSC)C(=O)NNC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H23N3O6S/c1-28-16-6-4-3-5-14(16)20(26)22-15(9-10-31-2)21(27)24-23-19(25)13-7-8-17-18(11-13)30-12-29-17/h3-8,11,15H,9-10,12H2,1-2H3,(H,22,26)(H,23,25)(H,24,27)