1-[(3-methoxy-4-oxidanyl-phenyl)methyl]-3-octyl-thiourea

Systemtic Name: 1-[(3-methoxy-4-oxidanyl-phenyl)methyl]-3-octyl-thiourea Openeye Name: 1-[(4-hydroxy-3-methoxy-phenyl)methyl]-3-octyl-thiourea CAS Name: 1-[(4-hydroxy-3-methoxyphenyl)methyl]-3-octylthiourea IUPAC Name: 1-[(4-hydroxy-3-methoxyphenyl)methyl]-3-octylthiourea Traditional Name: 1-octyl-3-vanillyl-thiourea Formula: C17H28N2O2S MolecularWeight: 324.48142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=S)NCC1=CC(=C(C=C1)O)OC

Isomeric SMILES

CCCCCCCCNC(=S)NCC1=CC(=C(C=C1)O)OC

InChI

InChI=1S/C17H28N2O2S/c1-3-4-5-6-7-8-11-18-17(22)19-13-14-9-10-15(20)16(12-14)21-2/h9-10,12,20H,3-8,11,13H2,1-2H3,(H2,18,19,22)