5-methyl-N-[4-[C-(4-methylpiperazin-1-yl)carbonimidoyl]phenyl]-2-(3-methylsulfonylnaphthalen-2-yl)pyrazole-3-carboxamide

Systemtic Name: 5-methyl-N-[4-[C-(4-methylpiperazin-1-yl)carbonimidoyl]phenyl]-2-(3-methylsulfonylnaphthalen-2-yl)pyrazole-3-carboxamide Openeye Name: 5-methyl-N-[4-(4-methylpiperazine-1-carboximidoyl)phenyl]-2-(3-methylsulfonyl-2-naphthyl)pyrazole-3-carboxamide CAS Name: N-[4-[imino-(4-methyl-1-piperazinyl)methyl]phenyl]-5-methyl-2-(3-methylsulfonyl-2-naphthalenyl)-3-pyrazolecarboxamide IUPAC Name: 5-methyl-N-[4-(4-methylpiperazine-1-carboximidoyl)phenyl]-2-(3-methylsulfonylnaphthalen-2-yl)pyrazole-3-carboxamide Traditional Name: 2-(3-mesyl-2-naphthyl)-5-methyl-N-[4-(4-methylpiperazine-1-carboximidoyl)phenyl]pyrazole-3-carboxamide Formula: C28H30N6O3S MolecularWeight: 530.6412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)NC2=CC=C(C=C2)C(=N)N3CCN(CC3)C)C4=CC5=CC=CC=C5C=C4S(=O)(=O)C

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NC2=CC=C(C=C2)C(=N)N3CCN(CC3)C)C4=CC5=CC=CC=C5C=C4S(=O)(=O)C

InChI

InChI=1S/C28H30N6O3S/c1-19-16-25(34(31-19)24-17-21-6-4-5-7-22(21)18-26(24)38(3,36)37)28(35)30-23-10-8-20(9-11-23)27(29)33-14-12-32(2)13-15-33/h4-11,16-18,29H,12-15H2,1-3H3,(H,30,35)