1-[4-(5,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-naphthalen-1-yl-ethanone

Systemtic Name: 1-[4-(5,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-naphthalen-1-yl-ethanone Openeye Name: 1-[4-(5,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(1-naphthyl)ethanone CAS Name: 1-[4-(5,7-dimethyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-2-(1-naphthalenyl)ethanone IUPAC Name: 1-[4-(5,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-naphthalen-1-ylethanone Traditional Name: 1-[4-(5,7-dimethyl-1,3-benzothiazol-2-yl)piperazino]-2-(1-naphthyl)ethanone Formula: C25H25N3OS MolecularWeight: 415.5505

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(S2)N3CCN(CC3)C(=O)CC4=CC=CC5=CC=CC=C54)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(S2)N3CCN(CC3)C(=O)CC4=CC=CC5=CC=CC=C54)C

InChI

InChI=1S/C25H25N3OS/c1-17-14-18(2)24-22(15-17)26-25(30-24)28-12-10-27(11-13-28)23(29)16-20-8-5-7-19-6-3-4-9-21(19)20/h3-9,14-15H,10-13,16H2,1-2H3