1,3-bis(1,3-benzodioxol-5-ylmethyl)thiourea

Systemtic Name: 1,3-bis(1,3-benzodioxol-5-ylmethyl)thiourea Openeye Name: 1,3-bis(1,3-benzodioxol-5-ylmethyl)thiourea CAS Name: 1,3-bis(1,3-benzodioxol-5-ylmethyl)thiourea IUPAC Name: 1,3-bis(1,3-benzodioxol-5-ylmethyl)thiourea Traditional Name: 1,3-dipiperonylthiourea Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=S)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=S)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H16N2O4S/c24-17(18-7-11-1-3-13-15(5-11)22-9-20-13)19-8-12-2-4-14-16(6-12)23-10-21-14/h1-6H,7-10H2,(H2,18,19,24)