S-[2-[methyl-[3-(4-methylphenyl)prop-2-ynyl]amino]phenyl] N,N-dimethylcarbamothioate

Systemtic Name: S-[2-[methyl-[3-(4-methylphenyl)prop-2-ynyl]amino]phenyl] N,N-dimethylcarbamothioate Openeye Name: S-[2-[methyl-[3-(p-tolyl)prop-2-ynyl]amino]phenyl] N,N-dimethylcarbamothioate CAS Name: N,N-dimethylcarbamothioic acid S-[2-[methyl-[3-(4-methylphenyl)prop-2-ynyl]amino]phenyl] ester IUPAC Name: S-[2-[methyl-[3-(4-methylphenyl)prop-2-ynyl]amino]phenyl] N,N-dimethylcarbamothioate Traditional Name: N,N-dimethylthiocarbamic acid S-[2-[methyl-[3-(p-tolyl)prop-2-ynyl]amino]phenyl] ester Formula: C20H22N2OS MolecularWeight: 338.46648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CCN(C)C2=CC=CC=C2SC(=O)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C#CCN(C)C2=CC=CC=C2SC(=O)N(C)C

InChI

InChI=1S/C20H22N2OS/c1-16-11-13-17(14-12-16)8-7-15-22(4)18-9-5-6-10-19(18)24-20(23)21(2)3/h5-6,9-14H,15H2,1-4H3