3-(1,3-benzodioxol-5-ylmethyl)-1,1-bis(2-methylpropyl)thiourea

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-1,1-bis(2-methylpropyl)thiourea Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-1,1-diisobutyl-thiourea CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-1,1-bis(2-methylpropyl)thiourea IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-1,1-bis(2-methylpropyl)thiourea Traditional Name: 1,1-diisobutyl-3-piperonyl-thiourea Formula: C17H26N2O2S MolecularWeight: 322.46554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C(=S)NCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(C)CN(CC(C)C)C(=S)NCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C17H26N2O2S/c1-12(2)9-19(10-13(3)4)17(22)18-8-14-5-6-15-16(7-14)21-11-20-15/h5-7,12-13H,8-11H2,1-4H3,(H,18,22)