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

Systemtic Name: (E)-3-phenyl-1-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-1-[4-(4-isopropyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-phenyl-prop-2-en-1-one CAS Name: (E)-3-phenyl-1-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-phenyl-1-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-1-[4-(4-isopropyl-1,3-benzothiazol-2-yl)piperazino]-3-phenyl-prop-2-en-1-one Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3OS/c1-17(2)19-9-6-10-20-22(19)24-23(28-20)26-15-13-25(14-16-26)21(27)12-11-18-7-4-3-5-8-18/h3-12,17H,13-16H2,1-2H3/b12-11+