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

Systemtic Name: N-[4-(1,3-benzodioxol-5-ylcarbamothioylamino)phenyl]-N-methyl-ethanamide Openeye Name: N-[4-(1,3-benzodioxol-5-ylcarbamothioylamino)phenyl]-N-methyl-acetamide CAS Name: N-[4-[[(1,3-benzodioxol-5-ylamino)-sulfanylidenemethyl]amino]phenyl]-N-methylacetamide IUPAC Name: N-[4-(1,3-benzodioxol-5-ylcarbamothioylamino)phenyl]-N-methylacetamide Traditional Name: N-[4-(1,3-benzodioxol-5-ylthiocarbamoylamino)phenyl]-N-methyl-acetamide Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C)C1=CC=C(C=C1)NC(=S)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(=O)N(C)C1=CC=C(C=C1)NC(=S)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H17N3O3S/c1-11(21)20(2)14-6-3-12(4-7-14)18-17(24)19-13-5-8-15-16(9-13)23-10-22-15/h3-9H,10H2,1-2H3,(H2,18,19,24)