1-(1,3-benzodioxol-5-ylmethyl)-3-[(1R)-1-(4-methylphenyl)-2-morpholin-4-yl-ethyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(1R)-1-(4-methylphenyl)-2-morpholin-4-yl-ethyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(1R)-2-morpholino-1-(p-tolyl)ethyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(1R)-1-(4-methylphenyl)-2-(4-morpholinyl)ethyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ylethyl]thiourea Traditional Name: 1-[(1R)-2-morpholino-1-(p-tolyl)ethyl]-3-piperonyl-thiourea Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CN2CCOCC2)NC(=S)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](CN2CCOCC2)NC(=S)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H27N3O3S/c1-16-2-5-18(6-3-16)19(14-25-8-10-26-11-9-25)24-22(29)23-13-17-4-7-20-21(12-17)28-15-27-20/h2-7,12,19H,8-11,13-15H2,1H3,(H2,23,24,29)/t19-/m0/s1