2-(3-azanyl-1,2-benzoxazol-5-yl)-5-methyl-N-[4-(2-methylsulfonylphenyl)phenyl]pyrazole-3-carboxamide

Systemtic Name: 2-(3-azanyl-1,2-benzoxazol-5-yl)-5-methyl-N-[4-(2-methylsulfonylphenyl)phenyl]pyrazole-3-carboxamide Openeye Name: 2-(3-amino-1,2-benzoxazol-5-yl)-5-methyl-N-[4-(2-methylsulfonylphenyl)phenyl]pyrazole-3-carboxamide CAS Name: 2-(3-amino-1,2-benzoxazol-5-yl)-5-methyl-N-[4-(2-methylsulfonylphenyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 2-(3-amino-1,2-benzoxazol-5-yl)-5-methyl-N-[4-(2-methylsulfonylphenyl)phenyl]pyrazole-3-carboxamide Traditional Name: 2-(3-aminoindoxazen-5-yl)-N-[4-(2-mesylphenyl)phenyl]-5-methyl-pyrazole-3-carboxamide Formula: C25H21N5O4S MolecularWeight: 487.53034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)NC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)C)C4=CC5=C(C=C4)ON=C5N

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)C)C4=CC5=C(C=C4)ON=C5N

InChI

InChI=1S/C25H21N5O4S/c1-15-13-21(30(28-15)18-11-12-22-20(14-18)24(26)29-34-22)25(31)27-17-9-7-16(8-10-17)19-5-3-4-6-23(19)35(2,32)33/h3-14H,1-2H3,(H2,26,29)(H,27,31)