[1-(4-tert-butylphenyl)-3-methyl-butan-2-yl] N-pyridin-3-ylcarbamodithioate

Systemtic Name: [1-(4-tert-butylphenyl)-3-methyl-butan-2-yl] N-pyridin-3-ylcarbamodithioate Openeye Name: [1-[(4-tert-butylphenyl)methyl]-2-methyl-propyl] N-(3-pyridyl)carbamodithioate CAS Name: N-(3-pyridinyl)carbamodithioic acid [1-(4-tert-butylphenyl)-3-methylbutan-2-yl] ester IUPAC Name: [1-(4-tert-butylphenyl)-3-methylbutan-2-yl] N-pyridin-3-ylcarbamodithioate Traditional Name: N-(3-pyridyl)carbamodithioic acid [1-(4-tert-butylbenzyl)-2-methyl-propyl] ester Formula: C21H28N2S2 MolecularWeight: 372.59042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC1=CC=C(C=C1)C(C)(C)C)SC(=S)NC2=CN=CC=C2

Isomeric SMILES

CC(C)C(CC1=CC=C(C=C1)C(C)(C)C)SC(=S)NC2=CN=CC=C2

InChI

InChI=1S/C21H28N2S2/c1-15(2)19(25-20(24)23-18-7-6-12-22-14-18)13-16-8-10-17(11-9-16)21(3,4)5/h6-12,14-15,19H,13H2,1-5H3,(H,23,24)