(4-tert-butylphenyl)methyl N'-(4-ethoxyphenyl)carbamimidothioate

Systemtic Name: (4-tert-butylphenyl)methyl N'-(4-ethoxyphenyl)carbamimidothioate Openeye Name: 2-[(4-tert-butylphenyl)methyl]-3-(4-ethoxyphenyl)isothiourea CAS Name: N'-(4-ethoxyphenyl)carbamimidothioic acid (4-tert-butylphenyl)methyl ester IUPAC Name: (4-tert-butylphenyl)methyl N'-(4-ethoxyphenyl)carbamimidothioate Traditional Name: 2-(4-tert-butylbenzyl)-3-p-phenetyl-isothiourea Formula: C20H26N2OS MolecularWeight: 342.49824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N=C(N)SCC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N=C(N)SCC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C20H26N2OS/c1-5-23-18-12-10-17(11-13-18)22-19(21)24-14-15-6-8-16(9-7-15)20(2,3)4/h6-13H,5,14H2,1-4H3,(H2,21,22)