3-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-1-(2-morpholin-4-ylethyl)thiourea

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-1-(2-morpholin-4-ylethyl)thiourea Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-1-(2-morpholinoethyl)thiourea CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-(1-cyclohex-3-enylmethyl)-1-[2-(4-morpholinyl)ethyl]thiourea IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-1-(cyclohex-3-en-1-ylmethyl)-1-(2-morpholin-4-ylethyl)thiourea Traditional Name: 1-(cyclohex-3-en-1-ylmethyl)-1-(2-morpholinoethyl)-3-piperonyl-thiourea Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)CN(CCN2CCOCC2)C(=S)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CC(CC=C1)CN(CCN2CCOCC2)C(=S)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H31N3O3S/c29-22(23-15-19-6-7-20-21(14-19)28-17-27-20)25(16-18-4-2-1-3-5-18)9-8-24-10-12-26-13-11-24/h1-2,6-7,14,18H,3-5,8-13,15-17H2,(H,23,29)