S-phenylazanyl N-[4-methyl-5-[(2,4,6-trimethylphenyl)carbamoyl]-1,3-thiazol-2-yl]carbamothioate

Systemtic Name: S-phenylazanyl N-[4-methyl-5-[(2,4,6-trimethylphenyl)carbamoyl]-1,3-thiazol-2-yl]carbamothioate Openeye Name: S-anilino N-[4-methyl-5-[(2,4,6-trimethylphenyl)carbamoyl]thiazol-2-yl]carbamothioate CAS Name: N-[4-methyl-5-[oxo-(2,4,6-trimethylanilino)methyl]-2-thiazolyl]carbamothioic acid S-anilino ester IUPAC Name: S-anilino N-[4-methyl-5-[(2,4,6-trimethylphenyl)carbamoyl]-1,3-thiazol-2-yl]carbamothioate Traditional Name: N-[5-(mesitylcarbamoyl)-4-methyl-thiazol-2-yl]thiocarbamic acid S-anilino ester Formula: C21H22N4O2S2 MolecularWeight: 426.55498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C2=C(N=C(S2)NC(=O)SNC3=CC=CC=C3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C2=C(N=C(S2)NC(=O)SNC3=CC=CC=C3)C)C

InChI

InChI=1S/C21H22N4O2S2/c1-12-10-13(2)17(14(3)11-12)23-19(26)18-15(4)22-20(28-18)24-21(27)29-25-16-8-6-5-7-9-16/h5-11,25H,1-4H3,(H,23,26)(H,22,24,27)