1-(1,3-benzodioxol-5-ylmethylideneamino)-3-propan-2-yl-thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethylideneamino)-3-propan-2-yl-thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyleneamino)-3-isopropyl-thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethylideneamino)-3-propan-2-ylthiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethylideneamino)-3-propan-2-ylthiourea Traditional Name: 1-isopropyl-3-(piperonylideneamino)thiourea Formula: C12H15N3O2S MolecularWeight: 265.3314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NN=CC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(C)NC(=S)NN=CC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C12H15N3O2S/c1-8(2)14-12(18)15-13-6-9-3-4-10-11(5-9)17-7-16-10/h3-6,8H,7H2,1-2H3,(H2,14,15,18)