1-[(E)-[3-(1,3-benzodioxol-5-yl)-2-methyl-propylidene]amino]thiourea

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N3O2S/c1-8(6-14-15-12(13)18)4-9-2-3-10-11(5-9)17-7-16-10/h2-3,5-6,8H,4,7H2,1H3,(H3,13,15,18)/b14-6+