2-(2,6-dimethylphenyl)imino-5-ethanoyl-4-methyl-N-phenyl-1,3-thiazole-3-carbothioamide

Systemtic Name: 2-(2,6-dimethylphenyl)imino-5-ethanoyl-4-methyl-N-phenyl-1,3-thiazole-3-carbothioamide Openeye Name: 5-acetyl-2-(2,6-dimethylphenyl)imino-4-methyl-N-phenyl-thiazole-3-carbothioamide CAS Name: 5-acetyl-2-(2,6-dimethylphenyl)imino-4-methyl-N-phenyl-3-thiazolecarbothioamide IUPAC Name: 5-acetyl-2-(2,6-dimethylphenyl)imino-4-methyl-N-phenyl-1,3-thiazole-3-carbothioamide Traditional Name: 5-acetyl-2-(2,6-dimethylphenyl)imino-4-methyl-N-phenyl-4-thiazoline-3-carbothioamide Formula: C21H21N3OS2 MolecularWeight: 395.54094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N=C2N(C(=C(S2)C(=O)C)C)C(=S)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=CC=C1)C)N=C2N(C(=C(S2)C(=O)C)C)C(=S)NC3=CC=CC=C3

InChI

InChI=1S/C21H21N3OS2/c1-13-9-8-10-14(2)18(13)23-21-24(15(3)19(27-21)16(4)25)20(26)22-17-11-6-5-7-12-17/h5-12H,1-4H3,(H,22,26)