N-[3-(azepan-1-yl)propyl]-2-phenyl-imidazo[2,1-b][1,3]benzothiazole-6-carboxamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-2-phenyl-imidazo[2,1-b][1,3]benzothiazole-6-carboxamide Openeye Name: N-[3-(azepan-1-yl)propyl]-2-phenyl-imidazo[2,1-b][1,3]benzothiazole-6-carboxamide CAS Name: N-[3-(1-azepanyl)propyl]-2-phenyl-6-imidazo[2,1-b][1,3]benzothiazolecarboxamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-2-phenylimidazo[2,1-b][1,3]benzothiazole-6-carboxamide Traditional Name: N-[3-(azepan-1-yl)propyl]-2-phenyl-imidazo[2,1-b][1,3]benzothiazole-6-carboxamide Formula: C25H28N4OS MolecularWeight: 432.58102

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCNC(=O)C2=CC3=C(C=C2)N4C=C(N=C4S3)C5=CC=CC=C5

Isomeric SMILES

C1CCCN(CC1)CCCNC(=O)C2=CC3=C(C=C2)N4C=C(N=C4S3)C5=CC=CC=C5

InChI

InChI=1S/C25H28N4OS/c30-24(26-13-8-16-28-14-6-1-2-7-15-28)20-11-12-22-23(17-20)31-25-27-21(18-29(22)25)19-9-4-3-5-10-19/h3-5,9-12,17-18H,1-2,6-8,13-16H2,(H,26,30)