1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(1-ethylpyrrolidin-2-yl)methyl]thiourea

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(1-ethylpyrrolidin-2-yl)methyl]thiourea Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(1-ethylpyrrolidin-2-yl)methyl]thiourea CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(1-ethyl-2-pyrrolidinyl)methyl]thiourea IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(1-ethylpyrrolidin-2-yl)methyl]thiourea Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(1-ethylpyrrolidin-2-yl)methyl]thiourea Formula: C16H23N3O2S MolecularWeight: 321.43772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC(=S)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCN1CCCC1CNC(=S)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C16H23N3O2S/c1-2-19-7-3-4-13(19)11-17-16(22)18-12-5-6-14-15(10-12)21-9-8-20-14/h5-6,10,13H,2-4,7-9,11H2,1H3,(H2,17,18,22)