1-(1,3-benzodioxol-5-ylmethyl)-3-cyclooctyl-1-[(5-methylfuran-2-yl)methyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-cyclooctyl-1-[(5-methylfuran-2-yl)methyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-cyclooctyl-1-[(5-methyl-2-furyl)methyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-cyclooctyl-1-[(5-methyl-2-furanyl)methyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-cyclooctyl-1-[(5-methylfuran-2-yl)methyl]thiourea Traditional Name: 3-cyclooctyl-1-[(5-methyl-2-furyl)methyl]-1-piperonyl-thiourea Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN(CC2=CC3=C(C=C2)OCO3)C(=S)NC4CCCCCCC4

Isomeric SMILES

CC1=CC=C(O1)CN(CC2=CC3=C(C=C2)OCO3)C(=S)NC4CCCCCCC4

InChI

InChI=1S/C23H30N2O3S/c1-17-9-11-20(28-17)15-25(14-18-10-12-21-22(13-18)27-16-26-21)23(29)24-19-7-5-3-2-4-6-8-19/h9-13,19H,2-8,14-16H2,1H3,(H,24,29)