2-(4-dibenzofuran-2-yl-1,3-thiazol-2-yl)-3-(3-methyl-1-phenyl-5-piperidin-1-yl-pyrazol-4-yl)prop-2-enenitrile

Systemtic Name: 2-(4-dibenzofuran-2-yl-1,3-thiazol-2-yl)-3-(3-methyl-1-phenyl-5-piperidin-1-yl-pyrazol-4-yl)prop-2-enenitrile Openeye Name: 2-(4-dibenzofuran-2-ylthiazol-2-yl)-3-[3-methyl-1-phenyl-5-(1-piperidyl)pyrazol-4-yl]prop-2-enenitrile CAS Name: 2-[4-(2-dibenzofuranyl)-2-thiazolyl]-3-[3-methyl-1-phenyl-5-(1-piperidinyl)-4-pyrazolyl]-2-propenenitrile IUPAC Name: 2-(4-dibenzofuran-2-yl-1,3-thiazol-2-yl)-3-(3-methyl-1-phenyl-5-piperidin-1-ylpyrazol-4-yl)prop-2-enenitrile Traditional Name: 2-(4-dibenzofuran-2-ylthiazol-2-yl)-3-(3-methyl-1-phenyl-5-piperidino-pyrazol-4-yl)acrylonitrile Formula: C33H27N5OS MolecularWeight: 541.66538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=C(C#N)C2=NC(=CS2)C3=CC4=C(C=C3)OC5=CC=CC=C54)N6CCCCC6)C7=CC=CC=C7

Isomeric SMILES

CC1=NN(C(=C1C=C(C#N)C2=NC(=CS2)C3=CC4=C(C=C3)OC5=CC=CC=C54)N6CCCCC6)C7=CC=CC=C7

InChI

InChI=1S/C33H27N5OS/c1-22-27(33(37-16-8-3-9-17-37)38(36-22)25-10-4-2-5-11-25)19-24(20-34)32-35-29(21-40-32)23-14-15-31-28(18-23)26-12-6-7-13-30(26)39-31/h2,4-7,10-15,18-19,21H,3,8-9,16-17H2,1H3