(4-heptylsulfanylphenyl) N-methyl-N-phenyl-carbamate

Systemtic Name: (4-heptylsulfanylphenyl) N-methyl-N-phenyl-carbamate Openeye Name: (4-heptylsulfanylphenyl) N-methyl-N-phenyl-carbamate CAS Name: N-methyl-N-phenylcarbamic acid [4-(heptylthio)phenyl] ester IUPAC Name: (4-heptylsulfanylphenyl) N-methyl-N-phenylcarbamate Traditional Name: N-methyl-N-phenyl-carbamic acid [4-(heptylthio)phenyl] ester Formula: C21H27NO2S MolecularWeight: 357.50958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC1=CC=C(C=C1)OC(=O)N(C)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCSC1=CC=C(C=C1)OC(=O)N(C)C2=CC=CC=C2

InChI

InChI=1S/C21H27NO2S/c1-3-4-5-6-10-17-25-20-15-13-19(14-16-20)24-21(23)22(2)18-11-8-7-9-12-18/h7-9,11-16H,3-6,10,17H2,1-2H3