1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(3-methoxyphenyl)ethanoylamino]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(3-methoxyphenyl)ethanoylamino]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[2-(3-methoxyphenyl)acetyl]amino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[2-(3-methoxyphenyl)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[2-(3-methoxyphenyl)acetyl]amino]thiourea Traditional Name: 1-[[2-(3-methoxyphenyl)acetyl]amino]-3-piperonyl-thiourea Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC(=O)NNC(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC1=CC=CC(=C1)CC(=O)NNC(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H19N3O4S/c1-23-14-4-2-3-12(7-14)9-17(22)20-21-18(26)19-10-13-5-6-15-16(8-13)25-11-24-15/h2-8H,9-11H2,1H3,(H,20,22)(H2,19,21,26)