2-(2,5-dimethylpyrrol-1-yl)-N-(4-ethanoylphenyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: 2-(2,5-dimethylpyrrol-1-yl)-N-(4-ethanoylphenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: N-(4-acetylphenyl)-2-(2,5-dimethylpyrrol-1-yl)-1,3-benzothiazole-6-carboxamide CAS Name: N-(4-acetylphenyl)-2-(2,5-dimethyl-1-pyrrolyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(4-acetylphenyl)-2-(2,5-dimethylpyrrol-1-yl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-(4-acetylphenyl)-2-(2,5-dimethylpyrrol-1-yl)-1,3-benzothiazole-6-carboxamide Formula: C22H19N3O2S MolecularWeight: 389.47016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=NC3=C(S2)C=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)C)C

Isomeric SMILES

CC1=CC=C(N1C2=NC3=C(S2)C=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)C)C

InChI

InChI=1S/C22H19N3O2S/c1-13-4-5-14(2)25(13)22-24-19-11-8-17(12-20(19)28-22)21(27)23-18-9-6-16(7-10-18)15(3)26/h4-12H,1-3H3,(H,23,27)