3-[(6-methyl-1-phenyl-indazol-4-yl)amino]propyl 4-methylbenzenesulfonate

Systemtic Name: 3-[(6-methyl-1-phenyl-indazol-4-yl)amino]propyl 4-methylbenzenesulfonate Openeye Name: 3-[(6-methyl-1-phenyl-indazol-4-yl)amino]propyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3-[(6-methyl-1-phenyl-4-indazolyl)amino]propyl ester IUPAC Name: 3-[(6-methyl-1-phenylindazol-4-yl)amino]propyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3-[(6-methyl-1-phenyl-indazol-4-yl)amino]propyl ester Formula: C24H25N3O3S MolecularWeight: 435.5386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCNC2=CC(=CC3=C2C=NN3C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCNC2=CC(=CC3=C2C=NN3C4=CC=CC=C4)C

InChI

InChI=1S/C24H25N3O3S/c1-18-9-11-21(12-10-18)31(28,29)30-14-6-13-25-23-15-19(2)16-24-22(23)17-26-27(24)20-7-4-3-5-8-20/h3-5,7-12,15-17,25H,6,13-14H2,1-2H3