[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]methanone

Systemtic Name: [4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]methanone Openeye Name: [4-(1,3-benzoxazol-2-yl)-1-piperidyl]-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]methanone CAS Name: [4-(1,3-benzoxazol-2-yl)-1-piperidinyl]-[1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]methanone IUPAC Name: [4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-(1-benzyl-3-thiophen-2-ylpyrazol-4-yl)methanone Traditional Name: [4-(1,3-benzoxazol-2-yl)piperidino]-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]methanone Formula: C27H24N4O2S MolecularWeight: 468.57006

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3O2)C(=O)C4=CN(N=C4C5=CC=CS5)CC6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3O2)C(=O)C4=CN(N=C4C5=CC=CS5)CC6=CC=CC=C6

InChI

InChI=1S/C27H24N4O2S/c32-27(30-14-12-20(13-15-30)26-28-22-9-4-5-10-23(22)33-26)21-18-31(17-19-7-2-1-3-8-19)29-25(21)24-11-6-16-34-24/h1-11,16,18,20H,12-15,17H2