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

Systemtic Name: 2-(2,5-dimethylpyrrol-1-yl)-N-(2-thiophen-2-ylethyl)-1,3-benzothiazole-6-carboxamide Openeye Name: 2-(2,5-dimethylpyrrol-1-yl)-N-[2-(2-thienyl)ethyl]-1,3-benzothiazole-6-carboxamide CAS Name: 2-(2,5-dimethyl-1-pyrrolyl)-N-(2-thiophen-2-ylethyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: 2-(2,5-dimethylpyrrol-1-yl)-N-(2-thiophen-2-ylethyl)-1,3-benzothiazole-6-carboxamide Traditional Name: 2-(2,5-dimethylpyrrol-1-yl)-N-[2-(2-thienyl)ethyl]-1,3-benzothiazole-6-carboxamide Formula: C20H19N3OS2 MolecularWeight: 381.51436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=NC3=C(S2)C=C(C=C3)C(=O)NCCC4=CC=CS4)C

Isomeric SMILES

CC1=CC=C(N1C2=NC3=C(S2)C=C(C=C3)C(=O)NCCC4=CC=CS4)C

InChI

InChI=1S/C20H19N3OS2/c1-13-5-6-14(2)23(13)20-22-17-8-7-15(12-18(17)26-20)19(24)21-10-9-16-4-3-11-25-16/h3-8,11-12H,9-10H2,1-2H3,(H,21,24)