[3-butan-2-yl-5-(dimethylaminomethyl)-4-oxidanyl-phenyl]methyl N,N-dimethylcarbamodithioate

Systemtic Name: [3-butan-2-yl-5-(dimethylaminomethyl)-4-oxidanyl-phenyl]methyl N,N-dimethylcarbamodithioate Openeye Name: [3-(dimethylaminomethyl)-4-hydroxy-5-sec-butyl-phenyl]methyl N,N-dimethylcarbamodithioate CAS Name: N,N-dimethylcarbamodithioic acid [3-butan-2-yl-5-(dimethylaminomethyl)-4-hydroxyphenyl]methyl ester IUPAC Name: [3-butan-2-yl-5-(dimethylaminomethyl)-4-hydroxyphenyl]methyl N,N-dimethylcarbamodithioate Traditional Name: N,N-dimethylcarbamodithioic acid [3-(dimethylaminomethyl)-4-hydroxy-5-sec-butyl-benzyl] ester Formula: C17H28N2OS2 MolecularWeight: 340.54702

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=CC(=C1O)CN(C)C)CSC(=S)N(C)C

Isomeric SMILES

CCC(C)C1=CC(=CC(=C1O)CN(C)C)CSC(=S)N(C)C

InChI

InChI=1S/C17H28N2OS2/c1-7-12(2)15-9-13(11-22-17(21)19(5)6)8-14(16(15)20)10-18(3)4/h8-9,12,20H,7,10-11H2,1-6H3