2-[2,4-bis(chloranyl)phenoxy]-N-[(6-chloranyl-1,3-benzothiazol-2-yl)carbamothioyl]propanamide

Systemtic Name: 2-[2,4-bis(chloranyl)phenoxy]-N-[(6-chloranyl-1,3-benzothiazol-2-yl)carbamothioyl]propanamide Openeye Name: N-[(6-chloro-1,3-benzothiazol-2-yl)carbamothioyl]-2-(2,4-dichlorophenoxy)propanamide CAS Name: N-[[(6-chloro-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2-(2,4-dichlorophenoxy)propanamide IUPAC Name: N-[(6-chloro-1,3-benzothiazol-2-yl)carbamothioyl]-2-(2,4-dichlorophenoxy)propanamide Traditional Name: N-[(6-chloro-1,3-benzothiazol-2-yl)thiocarbamoyl]-2-(2,4-dichlorophenoxy)propionamide Formula: C17H12Cl3N3O2S2 MolecularWeight: 460.78508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=S)NC1=NC2=C(S1)C=C(C=C2)Cl)OC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C(=O)NC(=S)NC1=NC2=C(S1)C=C(C=C2)Cl)OC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H12Cl3N3O2S2/c1-8(25-13-5-3-9(18)6-11(13)20)15(24)22-16(26)23-17-21-12-4-2-10(19)7-14(12)27-17/h2-8H,1H3,(H2,21,22,23,24,26)