3,6-bis(chloranyl)-N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[[[2-(4-ethylphenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[[2-(4-ethylphenyl)benzotriazol-5-yl]carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[[2-(4-ethylphenyl)benzotriazol-5-yl]thiocarbamoyl]benzothiophene-2-carboxamide Formula: C24H17Cl2N5OS2 MolecularWeight: 526.46068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=C(C5=C(S4)C=C(C=C5)Cl)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=C(C5=C(S4)C=C(C=C5)Cl)Cl

InChI

InChI=1S/C24H17Cl2N5OS2/c1-2-13-3-7-16(8-4-13)31-29-18-10-6-15(12-19(18)30-31)27-24(33)28-23(32)22-21(26)17-9-5-14(25)11-20(17)34-22/h3-12H,2H2,1H3,(H2,27,28,32,33)