[4-[4-(4-ethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylphenyl]-phenyl-methanone

Systemtic Name: [4-[4-(4-ethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylphenyl]-phenyl-methanone Openeye Name: [4-[4-(4-ethyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]-phenyl-methanone CAS Name: [4-[[4-(4-ethyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-oxomethyl]phenyl]-phenylmethanone IUPAC Name: [4-[4-(4-ethyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]-phenylmethanone Traditional Name: [4-[4-(4-ethyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]-phenyl-methanone Formula: C27H25N3O2S MolecularWeight: 455.5713

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(=O)C5=CC=CC=C5

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H25N3O2S/c1-2-19-9-6-10-23-24(19)28-27(33-23)30-17-15-29(16-18-30)26(32)22-13-11-21(12-14-22)25(31)20-7-4-3-5-8-20/h3-14H,2,15-18H2,1H3