4-[(3Z)-4-(benzimidazol-1-yl)-6H-5,1,3-benzothiadiazocin-2-yl]morpholine

Systemtic Name: 4-[(3Z)-4-(benzimidazol-1-yl)-6H-5,1,3-benzothiadiazocin-2-yl]morpholine Openeye Name: 4-[(3Z)-4-(benzimidazol-1-yl)-6H-5,1,3-benzothiadiazocin-2-yl]morpholine CAS Name: 4-[(3Z)-4-(1-benzimidazolyl)-6H-5,1,3-benzothiadiazocin-2-yl]morpholine IUPAC Name: 4-[(3Z)-4-(benzimidazol-1-yl)-6H-5,1,3-benzothiadiazocin-2-yl]morpholine Traditional Name: 4-[(3Z)-4-(benzimidazol-1-yl)-6H-5,1,3-benzothiadiazocin-2-yl]morpholine Formula: C20H19N5OS MolecularWeight: 377.46276

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=CC=CC=C3CSC(=N2)N4C=NC5=CC=CC=C54

Isomeric SMILES

C1COCCN1C/2=NC3=CC=CC=C3CS/C(=N2)/N4C=NC5=CC=CC=C54

InChI

InChI=1S/C20H19N5OS/c1-2-6-16-15(5-1)13-27-20(23-19(22-16)24-9-11-26-12-10-24)25-14-21-17-7-3-4-8-18(17)25/h1-8,14H,9-13H2/b22-19?,23-20-