N-[2-(4-azanylisoquinolin-7-yl)-5-methyl-pyrazol-3-yl]-2-(2-methylsulfonylphenyl)benzamide

Systemtic Name: N-[2-(4-azanylisoquinolin-7-yl)-5-methyl-pyrazol-3-yl]-2-(2-methylsulfonylphenyl)benzamide Openeye Name: N-[2-(4-amino-7-isoquinolyl)-5-methyl-pyrazol-3-yl]-2-(2-methylsulfonylphenyl)benzamide CAS Name: N-[2-(4-amino-7-isoquinolinyl)-5-methyl-3-pyrazolyl]-2-(2-methylsulfonylphenyl)benzamide IUPAC Name: N-[2-(4-aminoisoquinolin-7-yl)-5-methylpyrazol-3-yl]-2-(2-methylsulfonylphenyl)benzamide Traditional Name: N-[2-(4-amino-7-isoquinolyl)-5-methyl-pyrazol-3-yl]-2-(2-mesylphenyl)benzamide Formula: C27H23N5O3S MolecularWeight: 497.56822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=CC=CC=C2C3=CC=CC=C3S(=O)(=O)C)C4=CC5=CN=CC(=C5C=C4)N

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=CC=CC=C2C3=CC=CC=C3S(=O)(=O)C)C4=CC5=CN=CC(=C5C=C4)N

InChI

InChI=1S/C27H23N5O3S/c1-17-13-26(32(31-17)19-11-12-20-18(14-19)15-29-16-24(20)28)30-27(33)23-9-4-3-7-21(23)22-8-5-6-10-25(22)36(2,34)35/h3-16H,28H2,1-2H3,(H,30,33)