1-(1,3-benzodioxol-5-ylmethyl)-3-[[3-(dimethylamino)phenyl]carbonylamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[3-(dimethylamino)phenyl]carbonylamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[3-(dimethylamino)benzoyl]amino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[[3-(dimethylamino)phenyl]-oxomethyl]amino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[3-(dimethylamino)benzoyl]amino]thiourea Traditional Name: 1-[[3-(dimethylamino)benzoyl]amino]-3-piperonyl-thiourea Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC(=C1)C(=O)NNC(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN(C)C1=CC=CC(=C1)C(=O)NNC(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H20N4O3S/c1-22(2)14-5-3-4-13(9-14)17(23)20-21-18(26)19-10-12-6-7-15-16(8-12)25-11-24-15/h3-9H,10-11H2,1-2H3,(H,20,23)(H2,19,21,26)