1-(1,3-benzodioxol-5-ylmethyl)-3-[(4-tert-butylphenyl)methyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(4-tert-butylphenyl)methyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(4-tert-butylphenyl)methyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(4-tert-butylphenyl)methyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(4-tert-butylphenyl)methyl]thiourea Traditional Name: 1-(4-tert-butylbenzyl)-3-piperonyl-thiourea Formula: C20H24N2O2S MolecularWeight: 356.48176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CNC(=S)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CNC(=S)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H24N2O2S/c1-20(2,3)16-7-4-14(5-8-16)11-21-19(25)22-12-15-6-9-17-18(10-15)24-13-23-17/h4-10H,11-13H2,1-3H3,(H2,21,22,25)