1-[2-[6-[(E)-hydroxyiminomethyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1,3-dimethyl-thiourea

Systemtic Name: 1-[2-[6-[(E)-hydroxyiminomethyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1,3-dimethyl-thiourea Openeye Name: 1-[2-[6-[(E)-hydroxyiminomethyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1,3-dimethyl-thiourea CAS Name: 1-[2-[6-[(E)-hydroxyiminomethyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1,3-dimethylthiourea IUPAC Name: 1-[2-[6-[(E)-hydroxyiminomethyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1,3-dimethylthiourea Traditional Name: 1-[2-[6-[(E)-hydroximinomethyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1,3-dimethyl-thiourea Formula: C14H19N3O4S MolecularWeight: 325.38336

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N(C)CCC1=CC2=C(C(=C1C=NO)OC)OCO2

Isomeric SMILES

CNC(=S)N(C)CCC1=CC2=C(C(=C1/C=N/O)OC)OCO2

InChI

InChI=1S/C14H19N3O4S/c1-15-14(22)17(2)5-4-9-6-11-13(21-8-20-11)12(19-3)10(9)7-16-18/h6-7,18H,4-5,8H2,1-3H3,(H,15,22)/b16-7+