3-(1H-benzimidazol-2-yl)-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)propanamide

Systemtic Name: 3-(1H-benzimidazol-2-yl)-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)propanamide Openeye Name: 3-(1H-benzimidazol-2-yl)-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)propanamide CAS Name: 3-(1H-benzimidazol-2-yl)-N-[2-(1-pyrrolidinyl)-1,3-benzothiazol-6-yl]propanamide IUPAC Name: 3-(1H-benzimidazol-2-yl)-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)propanamide Traditional Name: 3-(1H-benzimidazol-2-yl)-N-(2-pyrrolidino-1,3-benzothiazol-6-yl)propionamide Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC3=C(S2)C=C(C=C3)NC(=O)CCC4=NC5=CC=CC=C5N4

Isomeric SMILES

C1CCN(C1)C2=NC3=C(S2)C=C(C=C3)NC(=O)CCC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C21H21N5OS/c27-20(10-9-19-23-15-5-1-2-6-16(15)24-19)22-14-7-8-17-18(13-14)28-21(25-17)26-11-3-4-12-26/h1-2,5-8,13H,3-4,9-12H2,(H,22,27)(H,23,24)