1-(1,3-benzodioxol-5-ylmethyl)-3-[(2R)-2-oxidanyl-2-phenyl-ethyl]thiourea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2R)-2-oxidanyl-2-phenyl-ethyl]thiourea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2R)-2-hydroxy-2-phenyl-ethyl]thiourea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2R)-2-hydroxy-2-phenylethyl]thiourea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2R)-2-hydroxy-2-phenylethyl]thiourea Traditional Name: 1-[(2R)-2-hydroxy-2-phenyl-ethyl]-3-piperonyl-thiourea Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=S)NCC(C3=CC=CC=C3)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=S)NC[C@@H](C3=CC=CC=C3)O

InChI

InChI=1S/C17H18N2O3S/c20-14(13-4-2-1-3-5-13)10-19-17(23)18-9-12-6-7-15-16(8-12)22-11-21-15/h1-8,14,20H,9-11H2,(H2,18,19,23)/t14-/m0/s1