N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-4-pyrrol-1-yl-benzamide

Systemtic Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-4-pyrrol-1-yl-benzamide Openeye Name: N-(2-morpholino-1,3-benzothiazol-6-yl)-4-pyrrol-1-yl-benzamide CAS Name: N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]-4-(1-pyrrolyl)benzamide IUPAC Name: N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)-4-pyrrol-1-ylbenzamide Traditional Name: N-(2-morpholino-1,3-benzothiazol-6-yl)-4-pyrrol-1-yl-benzamide Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)N5C=CC=C5

Isomeric SMILES

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)C4=CC=C(C=C4)N5C=CC=C5

InChI

InChI=1S/C22H20N4O2S/c27-21(16-3-6-18(7-4-16)25-9-1-2-10-25)23-17-5-8-19-20(15-17)29-22(24-19)26-11-13-28-14-12-26/h1-10,15H,11-14H2,(H,23,27)