N-(1,3-benzodioxol-5-ylmethyl)-2-[2-[(3-methylphenyl)methylsulfanyl]ethanoylamino]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-[(3-methylphenyl)methylsulfanyl]ethanoylamino]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-(m-tolylmethylsulfanyl)acetyl]amino]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-[(3-methylphenyl)methylthio]-1-oxoethyl]amino]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-[(3-methylphenyl)methylsulfanyl]acetyl]amino]benzamide Traditional Name: 2-[[2-[(3-methylbenzyl)thio]acetyl]amino]-N-piperonyl-benzamide Formula: C25H24N2O4S MolecularWeight: 448.53406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSCC(=O)NC2=CC=CC=C2C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=CC=C1)CSCC(=O)NC2=CC=CC=C2C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C25H24N2O4S/c1-17-5-4-6-19(11-17)14-32-15-24(28)27-21-8-3-2-7-20(21)25(29)26-13-18-9-10-22-23(12-18)31-16-30-22/h2-12H,13-16H2,1H3,(H,26,29)(H,27,28)