5-methyl-2-(3-methylsulfonylnaphthalen-2-yl)-N-[4-(C-thiomorpholin-4-ylcarbonimidoyl)phenyl]pyrazole-3-carboxamide

Systemtic Name: 5-methyl-2-(3-methylsulfonylnaphthalen-2-yl)-N-[4-(C-thiomorpholin-4-ylcarbonimidoyl)phenyl]pyrazole-3-carboxamide Openeye Name: 5-methyl-2-(3-methylsulfonyl-2-naphthyl)-N-[4-(thiomorpholine-4-carboximidoyl)phenyl]pyrazole-3-carboxamide CAS Name: N-[4-[imino(thiomorpholin-4-yl)methyl]phenyl]-5-methyl-2-(3-methylsulfonyl-2-naphthalenyl)-3-pyrazolecarboxamide IUPAC Name: 5-methyl-2-(3-methylsulfonylnaphthalen-2-yl)-N-[4-(thiomorpholine-4-carboximidoyl)phenyl]pyrazole-3-carboxamide Traditional Name: 2-(3-mesyl-2-naphthyl)-5-methyl-N-[4-(thiomorpholine-4-carboximidoyl)phenyl]pyrazole-3-carboxamide Formula: C27H27N5O3S2 MolecularWeight: 533.66498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)NC2=CC=C(C=C2)C(=N)N3CCSCC3)C4=CC5=CC=CC=C5C=C4S(=O)(=O)C

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NC2=CC=C(C=C2)C(=N)N3CCSCC3)C4=CC5=CC=CC=C5C=C4S(=O)(=O)C

InChI

InChI=1S/C27H27N5O3S2/c1-18-15-24(27(33)29-22-9-7-19(8-10-22)26(28)31-11-13-36-14-12-31)32(30-18)23-16-20-5-3-4-6-21(20)17-25(23)37(2,34)35/h3-10,15-17,28H,11-14H2,1-2H3,(H,29,33)