5-ethylsulfanyl-1-(4-methoxyphenyl)sulfonyl-2-[(4-methylpiperazin-1-yl)methyl]indole

Systemtic Name: 5-ethylsulfanyl-1-(4-methoxyphenyl)sulfonyl-2-[(4-methylpiperazin-1-yl)methyl]indole Openeye Name: 5-ethylsulfanyl-1-(4-methoxyphenyl)sulfonyl-2-[(4-methylpiperazin-1-yl)methyl]indole CAS Name: 5-(ethylthio)-1-(4-methoxyphenyl)sulfonyl-2-[(4-methyl-1-piperazinyl)methyl]indole IUPAC Name: 5-ethylsulfanyl-1-(4-methoxyphenyl)sulfonyl-2-[(4-methylpiperazin-1-yl)methyl]indole Traditional Name: 5-(ethylthio)-1-(4-methoxyphenyl)sulfonyl-2-[(4-methylpiperazino)methyl]indole Formula: C23H29N3O3S2 MolecularWeight: 459.62466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC2=C(C=C1)N(C(=C2)CN3CCN(CC3)C)S(=O)(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CCSC1=CC2=C(C=C1)N(C(=C2)CN3CCN(CC3)C)S(=O)(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H29N3O3S2/c1-4-30-21-7-10-23-18(16-21)15-19(17-25-13-11-24(2)12-14-25)26(23)31(27,28)22-8-5-20(29-3)6-9-22/h5-10,15-16H,4,11-14,17H2,1-3H3