1-(1,3-benzodioxol-5-ylmethyl)-3-(2,5-diethoxy-4-morpholin-4-yl-phenyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2,5-diethoxy-4-morpholin-4-yl-phenyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2,5-diethoxy-4-morpholino-phenyl)thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2,5-diethoxy-4-(4-morpholinyl)phenyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-(2,5-diethoxy-4-morpholin-4-ylphenyl)thiourea Traditional Name: 1-(2,5-diethoxy-4-morpholino-phenyl)-3-piperonyl-thiourea Formula: C23H29N3O5S MolecularWeight: 459.55846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1N2CCOCC2)OCC)NC(=S)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC1=CC(=C(C=C1N2CCOCC2)OCC)NC(=S)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H29N3O5S/c1-3-28-20-13-18(26-7-9-27-10-8-26)21(29-4-2)12-17(20)25-23(32)24-14-16-5-6-19-22(11-16)31-15-30-19/h5-6,11-13H,3-4,7-10,14-15H2,1-2H3,(H2,24,25,32)