(E)-3-(1,3-benzothiazol-2-yl)-1-[4-(4-ethanoylphenyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(1,3-benzothiazol-2-yl)-1-[4-(4-ethanoylphenyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-1-[4-(4-acetylphenyl)piperazin-1-yl]-3-(1,3-benzothiazol-2-yl)prop-2-en-1-one CAS Name: (E)-1-[4-(4-acetylphenyl)-1-piperazinyl]-3-(1,3-benzothiazol-2-yl)-2-propen-1-one IUPAC Name: (E)-1-[4-(4-acetylphenyl)piperazin-1-yl]-3-(1,3-benzothiazol-2-yl)prop-2-en-1-one Traditional Name: (E)-1-[4-(4-acetylphenyl)piperazino]-3-(1,3-benzothiazol-2-yl)prop-2-en-1-one Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C=CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)/C=C/C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H21N3O2S/c1-16(26)17-6-8-18(9-7-17)24-12-14-25(15-13-24)22(27)11-10-21-23-19-4-2-3-5-20(19)28-21/h2-11H,12-15H2,1H3/b11-10+