1-[(5-oxidanyl-1-benzofuran-3-yl)methoxy]-3-propyl-thiourea

Systemtic Name: 1-[(5-oxidanyl-1-benzofuran-3-yl)methoxy]-3-propyl-thiourea Openeye Name: 1-[(5-hydroxybenzofuran-3-yl)methoxy]-3-propyl-thiourea CAS Name: 1-[(5-hydroxy-3-benzofuranyl)methoxy]-3-propylthiourea IUPAC Name: 1-[(5-hydroxy-1-benzofuran-3-yl)methoxy]-3-propylthiourea Traditional Name: 1-[(5-hydroxybenzofuran-3-yl)methoxy]-3-propyl-thiourea Formula: C13H16N2O3S MolecularWeight: 280.34274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)NOCC1=COC2=C1C=C(C=C2)O

Isomeric SMILES

CCCNC(=S)NOCC1=COC2=C1C=C(C=C2)O

InChI

InChI=1S/C13H16N2O3S/c1-2-5-14-13(19)15-18-8-9-7-17-12-4-3-10(16)6-11(9)12/h3-4,6-7,16H,2,5,8H2,1H3,(H2,14,15,19)