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

Systemtic Name: N-(3-acetamidophenyl)-2-(2,5-dimethylpyrrol-1-yl)-1,3-benzothiazole-6-carboxamide Openeye Name: N-(3-acetamidophenyl)-2-(2,5-dimethylpyrrol-1-yl)-1,3-benzothiazole-6-carboxamide CAS Name: N-(3-acetamidophenyl)-2-(2,5-dimethyl-1-pyrrolyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(3-acetamidophenyl)-2-(2,5-dimethylpyrrol-1-yl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-(3-acetamidophenyl)-2-(2,5-dimethylpyrrol-1-yl)-1,3-benzothiazole-6-carboxamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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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(=CC=C4)NC(=O)C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H20N4O2S/c1-13-7-8-14(2)26(13)22-25-19-10-9-16(11-20(19)29-22)21(28)24-18-6-4-5-17(12-18)23-15(3)27/h4-12H,1-3H3,(H,23,27)(H,24,28)