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

Systemtic Name: (E)-1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one CAS Name: (E)-1-[2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-3-(1-phenyl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-1-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-1-[2-(1,3-benzothiazol-2-yl)pyrrolidino]-3-(1-phenylpyrazol-4-yl)prop-2-en-1-one Formula: C23H20N4OS MolecularWeight: 400.4961

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C=CC2=CN(N=C2)C3=CC=CC=C3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CC(N(C1)C(=O)/C=C/C2=CN(N=C2)C3=CC=CC=C3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H20N4OS/c28-22(13-12-17-15-24-27(16-17)18-7-2-1-3-8-18)26-14-6-10-20(26)23-25-19-9-4-5-11-21(19)29-23/h1-5,7-9,11-13,15-16,20H,6,10,14H2/b13-12+