(4-tert-butylphenyl)methyl N'-(2-methylpropyl)carbamimidothioate

Systemtic Name: (4-tert-butylphenyl)methyl N'-(2-methylpropyl)carbamimidothioate Openeye Name: 2-[(4-tert-butylphenyl)methyl]-3-isobutyl-isothiourea CAS Name: N'-(2-methylpropyl)carbamimidothioic acid (4-tert-butylphenyl)methyl ester IUPAC Name: (4-tert-butylphenyl)methyl N'-(2-methylpropyl)carbamimidothioate Traditional Name: 2-(4-tert-butylbenzyl)-3-isobutyl-isothiourea Formula: C16H26N2S MolecularWeight: 278.45604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2S/c1-12(2)10-18-15(17)19-11-13-6-8-14(9-7-13)16(3,4)5/h6-9,12H,10-11H2,1-5H3,(H2,17,18)