dipropylcarbamothioyl (E)-N-[(2,6-dimethylphenyl)amino]benzenecarboximidothioate

Systemtic Name: dipropylcarbamothioyl (E)-N-[(2,6-dimethylphenyl)amino]benzenecarboximidothioate Openeye Name: dipropylcarbamothioyl (E)-N-(2,6-dimethylanilino)benzenecarboximidothioate CAS Name: (E)-N-(2,6-dimethylanilino)benzenecarboximidothioic acid [(dipropylamino)-sulfanylidenemethyl] ester IUPAC Name: dipropylcarbamothioyl (E)-N-(2,6-dimethylanilino)benzenecarboximidothioate Traditional Name: (E)-N-(2,6-dimethylanilino)benzenecarboximidothioic acid dipropylthiocarbamoyl ester Formula: C22H29N3S2 MolecularWeight: 399.61576

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=S)SC(=NNC1=C(C=CC=C1C)C)C2=CC=CC=C2

Isomeric SMILES

CCCN(CCC)C(=S)S/C(=N/NC1=C(C=CC=C1C)C)/C2=CC=CC=C2

InChI

InChI=1S/C22H29N3S2/c1-5-15-25(16-6-2)22(26)27-21(19-13-8-7-9-14-19)24-23-20-17(3)11-10-12-18(20)4/h7-14,23H,5-6,15-16H2,1-4H3/b24-21+