(E)-2-(1H-benzimidazol-2-yl)-1-morpholin-4-yl-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-en-1-one

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-1-morpholin-4-yl-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-en-1-one Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-1-morpholino-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]prop-2-en-1-one CAS Name: (E)-2-(1H-benzimidazol-2-yl)-1-(4-morpholinyl)-3-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)-2-propen-1-one IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-1-morpholin-4-yl-3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-en-1-one Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-1-morpholino-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]prop-2-en-1-one Formula: C27H23N5O2S MolecularWeight: 481.56882

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C(=CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C5=NC6=CC=CC=C6N5

Isomeric SMILES

C1COCCN1C(=O)/C(=C/C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)/C5=NC6=CC=CC=C6N5

InChI

InChI=1S/C27H23N5O2S/c33-27(31-12-14-34-15-13-31)21(26-28-22-9-4-5-10-23(22)29-26)17-19-18-32(20-7-2-1-3-8-20)30-25(19)24-11-6-16-35-24/h1-11,16-18H,12-15H2,(H,28,29)/b21-17+