3-chloranyl-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-(4-ethoxyphenyl)-5-benzotriazolyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(2-p-phenetylbenzotriazol-5-yl)benzothiophene-2-carboxamide Formula: C23H17ClN4O2S MolecularWeight: 448.92468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=C(C5=CC=CC=C5S4)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=C(C5=CC=CC=C5S4)Cl

InChI

InChI=1S/C23H17ClN4O2S/c1-2-30-16-10-8-15(9-11-16)28-26-18-12-7-14(13-19(18)27-28)25-23(29)22-21(24)17-5-3-4-6-20(17)31-22/h3-13H,2H2,1H3,(H,25,29)