azepan-1-yl-[4-[(4-chloranylpyrazol-1-yl)methyl]thiophen-2-yl]methanone

Systemtic Name: azepan-1-yl-[4-[(4-chloranylpyrazol-1-yl)methyl]thiophen-2-yl]methanone Openeye Name: azepan-1-yl-[4-[(4-chloropyrazol-1-yl)methyl]-2-thienyl]methanone CAS Name: 1-azepanyl-[4-[(4-chloro-1-pyrazolyl)methyl]-2-thiophenyl]methanone IUPAC Name: azepan-1-yl-[4-[(4-chloropyrazol-1-yl)methyl]thiophen-2-yl]methanone Traditional Name: azepan-1-yl-[4-[(4-chloropyrazol-1-yl)methyl]-2-thienyl]methanone Formula: C15H18ClN3OS MolecularWeight: 323.84092

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC(=CS2)CN3C=C(C=N3)Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC(=CS2)CN3C=C(C=N3)Cl

InChI

InChI=1S/C15H18ClN3OS/c16-13-8-17-19(10-13)9-12-7-14(21-11-12)15(20)18-5-3-1-2-4-6-18/h7-8,10-11H,1-6,9H2