N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-3-chloranyl-4-ethoxy-benzamide

Systemtic Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-3-chloranyl-4-ethoxy-benzamide Openeye Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-3-chloro-4-ethoxy-benzamide CAS Name: N-[[2-(1,3-benzothiazol-2-yl)anilino]-sulfanylidenemethyl]-3-chloro-4-ethoxybenzamide IUPAC Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl]-3-chloro-4-ethoxybenzamide Traditional Name: N-[[2-(1,3-benzothiazol-2-yl)phenyl]thiocarbamoyl]-3-chloro-4-ethoxy-benzamide Formula: C23H18ClN3O2S2 MolecularWeight: 467.99092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C3=NC4=CC=CC=C4S3)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C3=NC4=CC=CC=C4S3)Cl

InChI

InChI=1S/C23H18ClN3O2S2/c1-2-29-19-12-11-14(13-16(19)24)21(28)27-23(30)26-17-8-4-3-7-15(17)22-25-18-9-5-6-10-20(18)31-22/h3-13H,2H2,1H3,(H2,26,27,28,30)