(phenylmethyl) N-[4-[4-(dimethylaminomethyl)phenyl]cyclohexyl]-N-hexyl-carbamodithioate

Systemtic Name: (phenylmethyl) N-[4-[4-(dimethylaminomethyl)phenyl]cyclohexyl]-N-hexyl-carbamodithioate Openeye Name: benzyl N-[4-[4-(dimethylaminomethyl)phenyl]cyclohexyl]-N-hexyl-carbamodithioate CAS Name: N-[4-[4-(dimethylaminomethyl)phenyl]cyclohexyl]-N-hexylcarbamodithioic acid (phenylmethyl) ester IUPAC Name: benzyl N-[4-[4-(dimethylaminomethyl)phenyl]cyclohexyl]-N-hexylcarbamodithioate Traditional Name: N-[4-[4-(dimethylaminomethyl)phenyl]cyclohexyl]-N-hexyl-carbamodithioic acid benzyl ester Formula: C29H42N2S2 MolecularWeight: 482.78718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(C1CCC(CC1)C2=CC=C(C=C2)CN(C)C)C(=S)SCC3=CC=CC=C3

Isomeric SMILES

CCCCCCN(C1CCC(CC1)C2=CC=C(C=C2)CN(C)C)C(=S)SCC3=CC=CC=C3

InChI

InChI=1S/C29H42N2S2/c1-4-5-6-10-21-31(29(32)33-23-25-11-8-7-9-12-25)28-19-17-27(18-20-28)26-15-13-24(14-16-26)22-30(2)3/h7-9,11-16,27-28H,4-6,10,17-23H2,1-3H3