1-(1,3-benzodioxol-5-ylmethyl)-3-[(1R)-1-phenylethyl]-1-(phenylmethyl)thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(1R)-1-phenylethyl]-1-(phenylmethyl)thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-3-[(1R)-1-phenylethyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(1R)-1-phenylethyl]-1-(phenylmethyl)thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-3-[(1R)-1-phenylethyl]thiourea Traditional Name: 1-benzyl-3-[(1R)-1-phenylethyl]-1-piperonyl-thiourea Formula: C24H24N2O2S MolecularWeight: 404.52456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=S)N(CC2=CC=CC=C2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=S)N(CC2=CC=CC=C2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H24N2O2S/c1-18(21-10-6-3-7-11-21)25-24(29)26(15-19-8-4-2-5-9-19)16-20-12-13-22-23(14-20)28-17-27-22/h2-14,18H,15-17H2,1H3,(H,25,29)/t18-/m1/s1