1-[4-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylphenyl]ethanone

Systemtic Name: 1-[4-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylphenyl]ethanone Openeye Name: 1-[4-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]ethanone CAS Name: 1-[4-[[4-(4-ethoxy-1,3-benzothiazol-2-yl)-1-piperazinyl]-oxomethyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]ethanone Traditional Name: 1-[4-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]ethanone Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(=O)C

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(=O)C

InChI

InChI=1S/C22H23N3O3S/c1-3-28-18-5-4-6-19-20(18)23-22(29-19)25-13-11-24(12-14-25)21(27)17-9-7-16(8-10-17)15(2)26/h4-10H,3,11-14H2,1-2H3