N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-5-methyl-1-(3-methylphenyl)pyrazole-4-carboxamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-5-methyl-1-(3-methylphenyl)pyrazole-4-carboxamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-5-methyl-1-(m-tolyl)pyrazole-4-carboxamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-5-methyl-1-(3-methylphenyl)-4-pyrazolecarboxamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-5-methyl-1-(3-methylphenyl)pyrazole-4-carboxamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-5-methyl-1-(m-tolyl)pyrazole-4-carboxamide Formula: C25H30N4O4S MolecularWeight: 482.5951

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C=N2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCCCCC4)OC)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(C=N2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCCCCC4)OC)C

InChI

InChI=1S/C25H30N4O4S/c1-18-9-8-10-20(15-18)29-19(2)22(17-26-29)25(30)27-23-16-21(11-12-24(23)33-3)34(31,32)28-13-6-4-5-7-14-28/h8-12,15-17H,4-7,13-14H2,1-3H3,(H,27,30)