(4-propan-2-ylphenyl)methyl N'-(4-methoxyphenyl)carbamimidothioate

Systemtic Name: (4-propan-2-ylphenyl)methyl N'-(4-methoxyphenyl)carbamimidothioate Openeye Name: 2-[(4-isopropylphenyl)methyl]-3-(4-methoxyphenyl)isothiourea CAS Name: N'-(4-methoxyphenyl)carbamimidothioic acid (4-propan-2-ylphenyl)methyl ester IUPAC Name: (4-propan-2-ylphenyl)methyl N'-(4-methoxyphenyl)carbamimidothioate Traditional Name: 2-(4-isopropylbenzyl)-3-(4-methoxyphenyl)isothiourea Formula: C18H22N2OS MolecularWeight: 314.44508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CSC(=NC2=CC=C(C=C2)OC)N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CSC(=NC2=CC=C(C=C2)OC)N

InChI

InChI=1S/C18H22N2OS/c1-13(2)15-6-4-14(5-7-15)12-22-18(19)20-16-8-10-17(21-3)11-9-16/h4-11,13H,12H2,1-3H3,(H2,19,20)