N-(2-adamantyl)-4-[(4-chloranylpyrazol-1-yl)methyl]thiophene-2-carboxamide

Systemtic Name: N-(2-adamantyl)-4-[(4-chloranylpyrazol-1-yl)methyl]thiophene-2-carboxamide Openeye Name: N-(2-adamantyl)-4-[(4-chloropyrazol-1-yl)methyl]thiophene-2-carboxamide CAS Name: N-(2-adamantyl)-4-[(4-chloro-1-pyrazolyl)methyl]-2-thiophenecarboxamide IUPAC Name: N-(2-adamantyl)-4-[(4-chloropyrazol-1-yl)methyl]thiophene-2-carboxamide Traditional Name: N-(2-adamantyl)-4-[(4-chloropyrazol-1-yl)methyl]thiophene-2-carboxamide Formula: C19H22ClN3OS MolecularWeight: 375.91548

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=O)C4=CC(=CS4)CN5C=C(C=N5)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=O)C4=CC(=CS4)CN5C=C(C=N5)Cl

InChI

InChI=1S/C19H22ClN3OS/c20-16-7-21-23(9-16)8-13-6-17(25-10-13)19(24)22-18-14-2-11-1-12(4-14)5-15(18)3-11/h6-7,9-12,14-15,18H,1-5,8H2,(H,22,24)