azepan-1-yl-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methanone

Systemtic Name: azepan-1-yl-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methanone Openeye Name: azepan-1-yl-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methanone CAS Name: 1-azepanyl-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methanone IUPAC Name: azepan-1-yl-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methanone Traditional Name: azepan-1-yl-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methanone Formula: C20H21N3OS MolecularWeight: 351.46524

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C20H21N3OS/c24-20(22-12-6-1-2-7-13-22)17-15-23(16-9-4-3-5-10-16)21-19(17)18-11-8-14-25-18/h3-5,8-11,14-15H,1-2,6-7,12-13H2