1-[[3-(1,3-benzodioxol-5-yl)-2-methyl-prop-1-enyl]amino]thiourea

Systemtic Name: 1-[[3-(1,3-benzodioxol-5-yl)-2-methyl-prop-1-enyl]amino]thiourea Openeye Name: [[3-(1,3-benzodioxol-5-yl)-2-methyl-prop-1-enyl]amino]thiourea CAS Name: [[3-(1,3-benzodioxol-5-yl)-2-methylprop-1-enyl]amino]thiourea IUPAC Name: [[3-(1,3-benzodioxol-5-yl)-2-methylprop-1-enyl]amino]thiourea Traditional Name: [[3-(1,3-benzodioxol-5-yl)-2-methyl-prop-1-enyl]amino]thiourea Formula: C12H15N3O2S MolecularWeight: 265.3314

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CNNC(=S)N)CC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(=CNNC(=S)N)CC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C12H15N3O2S/c1-8(6-14-15-12(13)18)4-9-2-3-10-11(5-9)17-7-16-10/h2-3,5-6,14H,4,7H2,1H3,(H3,13,15,18)