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

Systemtic Name: 2-(2,5-dimethylpyrrol-1-yl)-N-(2-methoxyphenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-(2,5-dimethylpyrrol-1-yl)-N-(2-methoxyphenyl)-1,3-benzothiazole-6-carboxamide CAS Name: 2-(2,5-dimethyl-1-pyrrolyl)-N-(2-methoxyphenyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-(2,5-dimethylpyrrol-1-yl)-N-(2-methoxyphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: 2-(2,5-dimethylpyrrol-1-yl)-N-(2-methoxyphenyl)-1,3-benzothiazole-6-carboxamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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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=C4OC)C

Isomeric SMILES

CC1=CC=C(N1C2=NC3=C(S2)C=C(C=C3)C(=O)NC4=CC=CC=C4OC)C

InChI

InChI=1S/C21H19N3O2S/c1-13-8-9-14(2)24(13)21-23-17-11-10-15(12-19(17)27-21)20(25)22-16-6-4-5-7-18(16)26-3/h4-12H,1-3H3,(H,22,25)