1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-(3-morpholin-4-ylpropyl)thiourea

Systemtic Name: 1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-(3-morpholin-4-ylpropyl)thiourea Openeye Name: 1-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-3-(3-morpholinopropyl)thiourea CAS Name: 1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-[3-(4-morpholinyl)propyl]thiourea IUPAC Name: 1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3-(3-morpholin-4-ylpropyl)thiourea Traditional Name: 1-(3-morpholinopropyl)-3-[(E)-piperonylideneamino]thiourea Formula: C16H22N4O3S MolecularWeight: 350.43588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(=S)NN=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1COCCN1CCCNC(=S)N/N=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H22N4O3S/c24-16(17-4-1-5-20-6-8-21-9-7-20)19-18-11-13-2-3-14-15(10-13)23-12-22-14/h2-3,10-11H,1,4-9,12H2,(H2,17,19,24)/b18-11+