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

Systemtic Name: 3,6-bis(chloranyl)-N-[2-(4-ethylphenyl)benzotriazol-5-yl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[2-(4-ethylphenyl)benzotriazol-5-yl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[2-(4-ethylphenyl)-5-benzotriazolyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[2-(4-ethylphenyl)benzotriazol-5-yl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[2-(4-ethylphenyl)benzotriazol-5-yl]benzothiophene-2-carboxamide Formula: C23H16Cl2N4OS MolecularWeight: 467.37034

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C23H16Cl2N4OS/c1-2-13-3-7-16(8-4-13)29-27-18-10-6-15(12-19(18)28-29)26-23(30)22-21(25)17-9-5-14(24)11-20(17)31-22/h3-12H,2H2,1H3,(H,26,30)