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

Systemtic Name: 3-butan-2-yl-1-[2-[6-[(E)-hydroxyiminomethyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1-methyl-thiourea Openeye Name: 1-[2-[6-[(E)-hydroxyiminomethyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1-methyl-3-sec-butyl-thiourea CAS Name: 3-butan-2-yl-1-[2-[6-[(E)-hydroxyiminomethyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1-methylthiourea IUPAC Name: 3-butan-2-yl-1-[2-[6-[(E)-hydroxyiminomethyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1-methylthiourea Traditional Name: 1-[2-[6-[(E)-hydroximinomethyl]-7-methoxy-1,3-benzodioxol-5-yl]ethyl]-1-methyl-3-sec-butyl-thiourea Formula: C17H25N3O4S MolecularWeight: 367.4631

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N3O4S/c1-5-11(2)19-17(25)20(3)7-6-12-8-14-16(24-10-23-14)15(22-4)13(12)9-18-21/h8-9,11,21H,5-7,10H2,1-4H3,(H,19,25)/b18-9+