N-[[5-(1,3-benzothiazol-2-yl)-2,4-bis(chloranyl)phenyl]carbamothioyl]-2-(2-methylphenoxy)ethanamide

Systemtic Name: N-[[5-(1,3-benzothiazol-2-yl)-2,4-bis(chloranyl)phenyl]carbamothioyl]-2-(2-methylphenoxy)ethanamide Openeye Name: N-[[5-(1,3-benzothiazol-2-yl)-2,4-dichloro-phenyl]carbamothioyl]-2-(2-methylphenoxy)acetamide CAS Name: N-[[5-(1,3-benzothiazol-2-yl)-2,4-dichloroanilino]-sulfanylidenemethyl]-2-(2-methylphenoxy)acetamide IUPAC Name: N-[[5-(1,3-benzothiazol-2-yl)-2,4-dichlorophenyl]carbamothioyl]-2-(2-methylphenoxy)acetamide Traditional Name: N-[[5-(1,3-benzothiazol-2-yl)-2,4-dichloro-phenyl]thiocarbamoyl]-2-(2-methylphenoxy)acetamide Formula: C23H17Cl2N3O2S2 MolecularWeight: 502.43598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(=O)NC(=S)NC2=C(C=C(C(=C2)C3=NC4=CC=CC=C4S3)Cl)Cl

Isomeric SMILES

CC1=CC=CC=C1OCC(=O)NC(=S)NC2=C(C=C(C(=C2)C3=NC4=CC=CC=C4S3)Cl)Cl

InChI

InChI=1S/C23H17Cl2N3O2S2/c1-13-6-2-4-8-19(13)30-12-21(29)28-23(31)27-18-10-14(15(24)11-16(18)25)22-26-17-7-3-5-9-20(17)32-22/h2-11H,12H2,1H3,(H2,27,28,29,31)