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

Systemtic Name: 3-bromanyl-5-ethoxy-1-(4-methoxyphenyl)sulfonyl-2-[(4-methylpiperazin-1-yl)methyl]indole Openeye Name: 3-bromo-5-ethoxy-1-(4-methoxyphenyl)sulfonyl-2-[(4-methylpiperazin-1-yl)methyl]indole CAS Name: 3-bromo-5-ethoxy-1-(4-methoxyphenyl)sulfonyl-2-[(4-methyl-1-piperazinyl)methyl]indole IUPAC Name: 3-bromo-5-ethoxy-1-(4-methoxyphenyl)sulfonyl-2-[(4-methylpiperazin-1-yl)methyl]indole Traditional Name: 3-bromo-5-ethoxy-1-(4-methoxyphenyl)sulfonyl-2-[(4-methylpiperazino)methyl]indole Formula: C23H28BrN3O4S MolecularWeight: 522.45512

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C23H28BrN3O4S/c1-4-31-18-7-10-21-20(15-18)23(24)22(16-26-13-11-25(2)12-14-26)27(21)32(28,29)19-8-5-17(30-3)6-9-19/h5-10,15H,4,11-14,16H2,1-3H3