2-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylidene]-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-3-one

Systemtic Name: 2-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylidene]-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-3-one Openeye Name: 2-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methylene]-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-3-one CAS Name: 2-[(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methylidene]-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-3-one IUPAC Name: 2-[(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methylidene]-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-3-one Traditional Name: 2-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methylene]-6,7,8,9-tetrahydro-5H-imidaz[1,2-a]azepin-3-one Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC(=CC3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5)C(=O)N2CC1

Isomeric SMILES

C1CCC2=NC(=CC3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5)C(=O)N2CC1

InChI

InChI=1S/C22H20N4OS/c27-22-18(23-20-11-5-2-6-12-25(20)22)14-16-15-26(17-8-3-1-4-9-17)24-21(16)19-10-7-13-28-19/h1,3-4,7-10,13-15H,2,5-6,11-12H2