3-chloranyl-N-[2-(4-methoxyphenyl)-6-methyl-benzotriazol-5-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-(4-methoxyphenyl)-6-methyl-benzotriazol-5-yl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-(4-methoxyphenyl)-6-methyl-benzotriazol-5-yl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-(4-methoxyphenyl)-6-methyl-5-benzotriazolyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-(4-methoxyphenyl)-6-methylbenzotriazol-5-yl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-(4-methoxyphenyl)-6-methyl-benzotriazol-5-yl]benzothiophene-2-carboxamide Formula: C23H17ClN4O2S MolecularWeight: 448.92468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(N=C2C=C1NC(=O)C3=C(C4=CC=CC=C4S3)Cl)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC2=NN(N=C2C=C1NC(=O)C3=C(C4=CC=CC=C4S3)Cl)C5=CC=C(C=C5)OC

InChI

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