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

Systemtic Name: 1-[4-(4,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(4-methoxyphenyl)ethanone Openeye Name: 1-[4-(4,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(4-methoxyphenyl)ethanone CAS Name: 1-[4-(4,7-dimethyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-2-(4-methoxyphenyl)ethanone IUPAC Name: 1-[4-(4,7-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(4-methoxyphenyl)ethanone Traditional Name: 1-[4-(4,7-dimethyl-1,3-benzothiazol-2-yl)piperazino]-2-(4-methoxyphenyl)ethanone Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C)SC(=N2)N3CCN(CC3)C(=O)CC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C2C(=C(C=C1)C)SC(=N2)N3CCN(CC3)C(=O)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C22H25N3O2S/c1-15-4-5-16(2)21-20(15)23-22(28-21)25-12-10-24(11-13-25)19(26)14-17-6-8-18(27-3)9-7-17/h4-9H,10-14H2,1-3H3