methyl 2-[[[(2S)-2-(2-chloranyl-5-methyl-phenoxy)propanoyl]amino]carbamothioylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[[[(2S)-2-(2-chloranyl-5-methyl-phenoxy)propanoyl]amino]carbamothioylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[[(2S)-2-(2-chloro-5-methyl-phenoxy)propanoyl]amino]carbamothioylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[[[(2S)-2-(2-chloro-5-methylphenoxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]amino]-5-methyl-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[[(2S)-2-(2-chloro-5-methylphenoxy)propanoyl]amino]carbamothioylamino]-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[[(2S)-2-(2-chloro-5-methyl-phenoxy)propanoyl]amino]thiocarbamoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C24H24ClN3O4S2 MolecularWeight: 518.04806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OC(C)C(=O)NNC(=S)NC2=C(C(=C(S2)C)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)O[C@@H](C)C(=O)NNC(=S)NC2=C(C(=C(S2)C)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C24H24ClN3O4S2/c1-13-10-11-17(25)18(12-13)32-14(2)21(29)27-28-24(33)26-22-20(23(30)31-4)19(15(3)34-22)16-8-6-5-7-9-16/h5-12,14H,1-4H3,(H,27,29)(H2,26,28,33)/t14-/m0/s1