azepan-1-yl-[1-(2-phenyl-5-thiophen-2-yl-pyrazol-3-yl)carbonylpiperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-(2-phenyl-5-thiophen-2-yl-pyrazol-3-yl)carbonylpiperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-[2-phenyl-5-(2-thienyl)pyrazole-3-carbonyl]-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[oxo-(2-phenyl-5-thiophen-2-yl-3-pyrazolyl)methyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-(2-phenyl-5-thiophen-2-ylpyrazole-3-carbonyl)piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-[2-phenyl-5-(2-thienyl)pyrazole-3-carbonyl]-4-piperidyl]methanone Formula: C26H30N4O2S MolecularWeight: 462.607

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=CC(=NN3C4=CC=CC=C4)C5=CC=CS5

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=CC(=NN3C4=CC=CC=C4)C5=CC=CS5

InChI

InChI=1S/C26H30N4O2S/c31-25(28-14-6-1-2-7-15-28)20-12-16-29(17-13-20)26(32)23-19-22(24-11-8-18-33-24)27-30(23)21-9-4-3-5-10-21/h3-5,8-11,18-20H,1-2,6-7,12-17H2