N-(2-phenylsulfanylphenyl)-1-[(4-propan-2-ylphenoxy)methyl]pyrazole-3-carboxamide

Systemtic Name: N-(2-phenylsulfanylphenyl)-1-[(4-propan-2-ylphenoxy)methyl]pyrazole-3-carboxamide Openeye Name: 1-[(4-isopropylphenoxy)methyl]-N-(2-phenylsulfanylphenyl)pyrazole-3-carboxamide CAS Name: N-[2-(phenylthio)phenyl]-1-[(4-propan-2-ylphenoxy)methyl]-3-pyrazolecarboxamide IUPAC Name: N-(2-phenylsulfanylphenyl)-1-[(4-propan-2-ylphenoxy)methyl]pyrazole-3-carboxamide Traditional Name: 1-[(4-isopropylphenoxy)methyl]-N-[2-(phenylthio)phenyl]pyrazole-3-carboxamide Formula: C26H25N3O2S MolecularWeight: 443.5606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NC3=CC=CC=C3SC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OCN2C=CC(=N2)C(=O)NC3=CC=CC=C3SC4=CC=CC=C4

InChI

InChI=1S/C26H25N3O2S/c1-19(2)20-12-14-21(15-13-20)31-18-29-17-16-24(28-29)26(30)27-23-10-6-7-11-25(23)32-22-8-4-3-5-9-22/h3-17,19H,18H2,1-2H3,(H,27,30)