N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-2-[(2-chloranylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-2-[(2-chloranylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: N-[4-(1-adamantyl)thiazol-2-yl]-2-[(2-chlorophenoxy)methyl]pyrazole-3-carboxamide CAS Name: N-[4-(1-adamantyl)-2-thiazolyl]-2-[(2-chlorophenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-[4-(1-adamantyl)-1,3-thiazol-2-yl]-2-[(2-chlorophenoxy)methyl]pyrazole-3-carboxamide Traditional Name: N-[4-(1-adamantyl)thiazol-2-yl]-2-[(2-chlorophenoxy)methyl]pyrazole-3-carboxamide Formula: C24H25ClN4O2S MolecularWeight: 468.9989

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CSC(=N4)NC(=O)C5=CC=NN5COC6=CC=CC=C6Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CSC(=N4)NC(=O)C5=CC=NN5COC6=CC=CC=C6Cl

InChI

InChI=1S/C24H25ClN4O2S/c25-18-3-1-2-4-20(18)31-14-29-19(5-6-26-29)22(30)28-23-27-21(13-32-23)24-10-15-7-16(11-24)9-17(8-15)12-24/h1-6,13,15-17H,7-12,14H2,(H,27,28,30)