(3-methoxyphenyl)methyl N'-(2-methylpropyl)carbamimidothioate

Systemtic Name: (3-methoxyphenyl)methyl N'-(2-methylpropyl)carbamimidothioate Openeye Name: 3-isobutyl-2-[(3-methoxyphenyl)methyl]isothiourea CAS Name: N'-(2-methylpropyl)carbamimidothioic acid (3-methoxyphenyl)methyl ester IUPAC Name: (3-methoxyphenyl)methyl N'-(2-methylpropyl)carbamimidothioate Traditional Name: 3-isobutyl-2-m-anisyl-isothiourea Formula: C13H20N2OS MolecularWeight: 252.3757

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN=C(N)SCC1=CC(=CC=C1)OC

Isomeric SMILES

CC(C)CN=C(N)SCC1=CC(=CC=C1)OC

InChI

InChI=1S/C13H20N2OS/c1-10(2)8-15-13(14)17-9-11-5-4-6-12(7-11)16-3/h4-7,10H,8-9H2,1-3H3,(H2,14,15)