1-(1,3-benzodioxol-5-ylmethyl)-3-(2-benzo[e][1]benzofuran-1-ylethanoylamino)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2-benzo[e][1]benzofuran-1-ylethanoylamino)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2-benzo[e]benzofuran-1-ylacetyl)amino]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[[2-(1-benzo[e]benzofuranyl)-1-oxoethyl]amino]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2-benzo[e][1]benzofuran-1-ylacetyl)amino]thiourea Traditional Name: 1-[(2-benzo[e]benzofuran-1-ylacetyl)amino]-3-piperonyl-thiourea Formula: C23H19N3O4S MolecularWeight: 433.47966

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=S)NNC(=O)CC3=COC4=C3C5=CC=CC=C5C=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=S)NNC(=O)CC3=COC4=C3C5=CC=CC=C5C=C4

InChI

InChI=1S/C23H19N3O4S/c27-21(10-16-12-28-19-8-6-15-3-1-2-4-17(15)22(16)19)25-26-23(31)24-11-14-5-7-18-20(9-14)30-13-29-18/h1-9,12H,10-11,13H2,(H,25,27)(H2,24,26,31)