(4-methoxypyridin-2-yl)methyl N,N'-bis(4-methoxyphenyl)carbamimidothioate

Systemtic Name: (4-methoxypyridin-2-yl)methyl N,N'-bis(4-methoxyphenyl)carbamimidothioate Openeye Name: 1,3-bis(4-methoxyphenyl)-2-[(4-methoxy-2-pyridyl)methyl]isothiourea CAS Name: N,N'-bis(4-methoxyphenyl)carbamimidothioic acid (4-methoxy-2-pyridinyl)methyl ester IUPAC Name: (4-methoxypyridin-2-yl)methyl N,N'-bis(4-methoxyphenyl)carbamimidothioate Traditional Name: 1,3-bis(4-methoxyphenyl)-2-[(4-methoxy-2-pyridyl)methyl]isothiourea Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=NC2=CC=C(C=C2)OC)SCC3=NC=CC(=C3)OC

Isomeric SMILES

COC1=CC=C(C=C1)NC(=NC2=CC=C(C=C2)OC)SCC3=NC=CC(=C3)OC

InChI

InChI=1S/C22H23N3O3S/c1-26-19-8-4-16(5-9-19)24-22(25-17-6-10-20(27-2)11-7-17)29-15-18-14-21(28-3)12-13-23-18/h4-14H,15H2,1-3H3,(H,24,25)