(4E)-4-(3H-1,3-benzothiazol-2-ylidene)-2-[(4-ethanoylpiperazin-1-yl)methyl]cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-4-(3H-1,3-benzothiazol-2-ylidene)-2-[(4-ethanoylpiperazin-1-yl)methyl]cyclohexa-2,5-dien-1-one Openeye Name: (4E)-2-[(4-acetylpiperazin-1-yl)methyl]-4-(3H-1,3-benzothiazol-2-ylidene)cyclohexa-2,5-dien-1-one CAS Name: (4E)-2-[(4-acetyl-1-piperazinyl)methyl]-4-(3H-1,3-benzothiazol-2-ylidene)-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-2-[(4-acetylpiperazin-1-yl)methyl]-4-(3H-1,3-benzothiazol-2-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: (4E)-2-[(4-acetylpiperazino)methyl]-4-(3H-1,3-benzothiazol-2-ylidene)cyclohexa-2,5-dien-1-one Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)CC2=CC(=C3NC4=CC=CC=C4S3)C=CC2=O

Isomeric SMILES

CC(=O)N1CCN(CC1)CC2=C/C(=C/3\NC4=CC=CC=C4S3)/C=CC2=O

InChI

InChI=1S/C20H21N3O2S/c1-14(24)23-10-8-22(9-11-23)13-16-12-15(6-7-18(16)25)20-21-17-4-2-3-5-19(17)26-20/h2-7,12,21H,8-11,13H2,1H3/b20-15+