1-(1,3-benzodioxol-5-ylmethyl)-3-(3-ethanoylphenyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(3-ethanoylphenyl)thiourea Openeye Name: 1-(3-acetylphenyl)-3-(1,3-benzodioxol-5-ylmethyl)thiourea CAS Name: 1-(3-acetylphenyl)-3-(1,3-benzodioxol-5-ylmethyl)thiourea IUPAC Name: 1-(3-acetylphenyl)-3-(1,3-benzodioxol-5-ylmethyl)thiourea Traditional Name: 1-(3-acetylphenyl)-3-piperonyl-thiourea Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O3S/c1-11(20)13-3-2-4-14(8-13)19-17(23)18-9-12-5-6-15-16(7-12)22-10-21-15/h2-8H,9-10H2,1H3,(H2,18,19,23)