3-(1-adamantyl)-N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(1-adamantyl)-N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(1-adamantyl)-N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(1-adamantyl)-N-[3-(4-chlorophenyl)sulfonyl-5-methoxyphenyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(1-adamantyl)-N-[3-(4-chlorophenyl)sulfonyl-5-methoxyphenyl]-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(1-adamantyl)-N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]-1-phenyl-pyrazole-4-carboxamide Formula: C33H32ClN3O4S MolecularWeight: 602.14288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)C2=CN(N=C2C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6)S(=O)(=O)C7=CC=C(C=C7)Cl

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)C2=CN(N=C2C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6)S(=O)(=O)C7=CC=C(C=C7)Cl

InChI

InChI=1S/C33H32ClN3O4S/c1-41-27-14-25(15-29(16-27)42(39,40)28-9-7-24(34)8-10-28)35-32(38)30-20-37(26-5-3-2-4-6-26)36-31(30)33-17-21-11-22(18-33)13-23(12-21)19-33/h2-10,14-16,20-23H,11-13,17-19H2,1H3,(H,35,38)