1-(1,3-benzodioxol-5-ylmethyl)-3-tert-butyl-1-(pyridin-2-ylmethyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-tert-butyl-1-(pyridin-2-ylmethyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-tert-butyl-1-(2-pyridylmethyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-tert-butyl-1-(2-pyridinylmethyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-tert-butyl-1-(pyridin-2-ylmethyl)thiourea Traditional Name: 3-tert-butyl-1-piperonyl-1-(2-pyridylmethyl)thiourea Formula: C19H23N3O2S MolecularWeight: 357.46982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CC=N3

Isomeric SMILES

CC(C)(C)NC(=S)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=CC=N3

InChI

InChI=1S/C19H23N3O2S/c1-19(2,3)21-18(25)22(12-15-6-4-5-9-20-15)11-14-7-8-16-17(10-14)24-13-23-16/h4-10H,11-13H2,1-3H3,(H,21,25)