N-[[2-(4-butylphenyl)-6-chloranyl-benzotriazol-5-yl]carbamothioyl]-2-(4-chlorophenyl)ethanamide

Systemtic Name: N-[[2-(4-butylphenyl)-6-chloranyl-benzotriazol-5-yl]carbamothioyl]-2-(4-chlorophenyl)ethanamide Openeye Name: N-[[2-(4-butylphenyl)-6-chloro-benzotriazol-5-yl]carbamothioyl]-2-(4-chlorophenyl)acetamide CAS Name: N-[[[2-(4-butylphenyl)-6-chloro-5-benzotriazolyl]amino]-sulfanylidenemethyl]-2-(4-chlorophenyl)acetamide IUPAC Name: N-[[2-(4-butylphenyl)-6-chlorobenzotriazol-5-yl]carbamothioyl]-2-(4-chlorophenyl)acetamide Traditional Name: N-[[2-(4-butylphenyl)-6-chloro-benzotriazol-5-yl]thiocarbamoyl]-2-(4-chlorophenyl)acetamide Formula: C25H23Cl2N5OS MolecularWeight: 512.45402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=S)NC(=O)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=S)NC(=O)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H23Cl2N5OS/c1-2-3-4-16-7-11-19(12-8-16)32-30-22-14-20(27)21(15-23(22)31-32)28-25(34)29-24(33)13-17-5-9-18(26)10-6-17/h5-12,14-15H,2-4,13H2,1H3,(H2,28,29,33,34)