imidazo[2,1-b][1,3]benzothiazol-2-yl-(4-phenethyl-1,4-diazepan-1-yl)methanone

Systemtic Name: imidazo[2,1-b][1,3]benzothiazol-2-yl-(4-phenethyl-1,4-diazepan-1-yl)methanone Openeye Name: imidazo[2,1-b][1,3]benzothiazol-2-yl-(4-phenethyl-1,4-diazepan-1-yl)methanone CAS Name: 2-imidazo[2,1-b][1,3]benzothiazolyl-(4-phenethyl-1,4-diazepan-1-yl)methanone IUPAC Name: imidazo[2,1-b][1,3]benzothiazol-2-yl-(4-phenethyl-1,4-diazepan-1-yl)methanone Traditional Name: imidazo[2,1-b][1,3]benzothiazol-2-yl-(4-phenethyl-1,4-diazepan-1-yl)methanone Formula: C23H24N4OS MolecularWeight: 404.52786

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CN3C4=CC=CC=C4SC3=N2)CCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CN3C4=CC=CC=C4SC3=N2)CCC5=CC=CC=C5

InChI

InChI=1S/C23H24N4OS/c28-22(19-17-27-20-9-4-5-10-21(20)29-23(27)24-19)26-13-6-12-25(15-16-26)14-11-18-7-2-1-3-8-18/h1-5,7-10,17H,6,11-16H2