3-bromanyl-5-ethoxy-1-(4-fluorophenyl)sulfonyl-2-[(4-methylpiperazin-1-yl)methyl]indole

Systemtic Name: 3-bromanyl-5-ethoxy-1-(4-fluorophenyl)sulfonyl-2-[(4-methylpiperazin-1-yl)methyl]indole Openeye Name: 3-bromo-5-ethoxy-1-(4-fluorophenyl)sulfonyl-2-[(4-methylpiperazin-1-yl)methyl]indole CAS Name: 3-bromo-5-ethoxy-1-(4-fluorophenyl)sulfonyl-2-[(4-methyl-1-piperazinyl)methyl]indole IUPAC Name: 3-bromo-5-ethoxy-1-(4-fluorophenyl)sulfonyl-2-[(4-methylpiperazin-1-yl)methyl]indole Traditional Name: 3-bromo-5-ethoxy-1-(4-fluorophenyl)sulfonyl-2-[(4-methylpiperazino)methyl]indole Formula: C22H25BrFN3O3S MolecularWeight: 510.419603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=C2Br)CN3CCN(CC3)C)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=C2Br)CN3CCN(CC3)C)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H25BrFN3O3S/c1-3-30-17-6-9-20-19(14-17)22(23)21(15-26-12-10-25(2)11-13-26)27(20)31(28,29)18-7-4-16(24)5-8-18/h4-9,14H,3,10-13,15H2,1-2H3