(2E,4E)-1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]hexa-2,4-dien-1-one

Systemtic Name: (2E,4E)-1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]hexa-2,4-dien-1-one Openeye Name: (2E,4E)-1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]hexa-2,4-dien-1-one CAS Name: (2E,4E)-1-[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]-1-hexa-2,4-dienone IUPAC Name: (2E,4E)-1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]hexa-2,4-dien-1-one Traditional Name: (2E,4E)-1-[4-(1,3-benzothiazol-2-ylmethyl)piperazino]hexa-2,4-dien-1-one Formula: C18H21N3OS MolecularWeight: 327.44384

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)N1CCN(CC1)CC2=NC3=CC=CC=C3S2

Isomeric SMILES

C/C=C/C=C/C(=O)N1CCN(CC1)CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H21N3OS/c1-2-3-4-9-18(22)21-12-10-20(11-13-21)14-17-19-15-7-5-6-8-16(15)23-17/h2-9H,10-14H2,1H3/b3-2+,9-4+