1-benzothiophen-2-yl N-[(4-hydroxyphenyl)methyl]-N-(2-methylpropyl)carbamimidothioate

Systemtic Name: 1-benzothiophen-2-yl N-[(4-hydroxyphenyl)methyl]-N-(2-methylpropyl)carbamimidothioate Openeye Name: 2-(benzothiophen-2-yl)-1-[(4-hydroxyphenyl)methyl]-1-isobutyl-isothiourea CAS Name: N-[(4-hydroxyphenyl)methyl]-N-(2-methylpropyl)carbamimidothioic acid 1-benzothiophen-2-yl ester IUPAC Name: 1-benzothiophen-2-yl N-[(4-hydroxyphenyl)methyl]-N-(2-methylpropyl)carbamimidothioate Traditional Name: 2-(benzothiophen-2-yl)-1-(4-hydroxybenzyl)-1-isobutyl-isothiourea Formula: C20H22N2OS2 MolecularWeight: 370.53148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1=CC=C(C=C1)O)C(=N)SC2=CC3=CC=CC=C3S2

Isomeric SMILES

CC(C)CN(CC1=CC=C(C=C1)O)C(=N)SC2=CC3=CC=CC=C3S2

InChI

InChI=1S/C20H22N2OS2/c1-14(2)12-22(13-15-7-9-17(23)10-8-15)20(21)25-19-11-16-5-3-4-6-18(16)24-19/h3-11,14,21,23H,12-13H2,1-2H3