N-[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Openeye Name: N-[2-oxo-2-[2-(2-thienyl)ethylamino]ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide CAS Name: N-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]-2-(1-pyrrolyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Traditional Name: N-[2-keto-2-[2-(2-thienyl)ethylamino]ethyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Formula: C20H18N4O2S2 MolecularWeight: 410.51252

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=NC3=C(S2)C=C(C=C3)C(=O)NCC(=O)NCCC4=CC=CS4

Isomeric SMILES

C1=CN(C=C1)C2=NC3=C(S2)C=C(C=C3)C(=O)NCC(=O)NCCC4=CC=CS4

InChI

InChI=1S/C20H18N4O2S2/c25-18(21-8-7-15-4-3-11-27-15)13-22-19(26)14-5-6-16-17(12-14)28-20(23-16)24-9-1-2-10-24/h1-6,9-12H,7-8,13H2,(H,21,25)(H,22,26)