1-[(3-methoxyphenyl)methyl]-3-octyl-thiourea

Systemtic Name: 1-[(3-methoxyphenyl)methyl]-3-octyl-thiourea Openeye Name: 1-[(3-methoxyphenyl)methyl]-3-octyl-thiourea CAS Name: 1-[(3-methoxyphenyl)methyl]-3-octylthiourea IUPAC Name: 1-[(3-methoxyphenyl)methyl]-3-octylthiourea Traditional Name: 1-m-anisyl-3-octyl-thiourea Formula: C17H28N2OS MolecularWeight: 308.48202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H28N2OS/c1-3-4-5-6-7-8-12-18-17(21)19-14-15-10-9-11-16(13-15)20-2/h9-11,13H,3-8,12,14H2,1-2H3,(H2,18,19,21)