S-[2-[3-(3-iodanylthiophen-2-yl)prop-2-ynylamino]phenyl] N,N-dimethylcarbamothioate

Systemtic Name: S-[2-[3-(3-iodanylthiophen-2-yl)prop-2-ynylamino]phenyl] N,N-dimethylcarbamothioate Openeye Name: S-[2-[3-(3-iodo-2-thienyl)prop-2-ynylamino]phenyl] N,N-dimethylcarbamothioate CAS Name: N,N-dimethylcarbamothioic acid S-[2-[3-(3-iodo-2-thiophenyl)prop-2-ynylamino]phenyl] ester IUPAC Name: S-[2-[3-(3-iodothiophen-2-yl)prop-2-ynylamino]phenyl] N,N-dimethylcarbamothioate Traditional Name: N,N-dimethylthiocarbamic acid S-[2-[3-(3-iodo-2-thienyl)prop-2-ynylamino]phenyl] ester Formula: C16H15IN2OS2 MolecularWeight: 442.33757

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)SC1=CC=CC=C1NCC#CC2=C(C=CS2)I

Isomeric SMILES

CN(C)C(=O)SC1=CC=CC=C1NCC#CC2=C(C=CS2)I

InChI

InChI=1S/C16H15IN2OS2/c1-19(2)16(20)22-15-7-4-3-6-13(15)18-10-5-8-14-12(17)9-11-21-14/h3-4,6-7,9,11,18H,10H2,1-2H3