N-[4-(1,3-benzodioxol-5-ylmethylcarbamothioylamino)phenyl]ethanamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-ylmethylcarbamothioylamino)phenyl]ethanamide Openeye Name: N-[4-(1,3-benzodioxol-5-ylmethylcarbamothioylamino)phenyl]acetamide CAS Name: N-[4-[[(1,3-benzodioxol-5-ylmethylamino)-sulfanylidenemethyl]amino]phenyl]acetamide IUPAC Name: N-[4-(1,3-benzodioxol-5-ylmethylcarbamothioylamino)phenyl]acetamide Traditional Name: N-[4-(piperonylthiocarbamoylamino)phenyl]acetamide Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H17N3O3S/c1-11(21)19-13-3-5-14(6-4-13)20-17(24)18-9-12-2-7-15-16(8-12)23-10-22-15/h2-8H,9-10H2,1H3,(H,19,21)(H2,18,20,24)