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

Systemtic Name: 3-butan-2-yl-1-[2-(6-methanoyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1-methyl-thiourea Openeye Name: 1-[2-(6-formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1-methyl-3-sec-butyl-thiourea CAS Name: 3-butan-2-yl-1-[2-(6-formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1-methylthiourea IUPAC Name: 3-butan-2-yl-1-[2-(6-formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1-methylthiourea Traditional Name: 1-[2-(6-formyl-7-methoxy-1,3-benzodioxol-5-yl)ethyl]-1-methyl-3-sec-butyl-thiourea Formula: C17H24N2O4S MolecularWeight: 352.44846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=S)N(C)CCC1=CC2=C(C(=C1C=O)OC)OCO2

Isomeric SMILES

CCC(C)NC(=S)N(C)CCC1=CC2=C(C(=C1C=O)OC)OCO2

InChI

InChI=1S/C17H24N2O4S/c1-5-11(2)18-17(24)19(3)7-6-12-8-14-16(23-10-22-14)15(21-4)13(12)9-20/h8-9,11H,5-7,10H2,1-4H3,(H,18,24)