3-[3-[4-(5-methoxypyrimidin-4-yl)-3-methyl-piperazin-1-yl]propyl]-5-(2-methylsulfonylethyl)-1H-indole

Systemtic Name: 3-[3-[4-(5-methoxypyrimidin-4-yl)-3-methyl-piperazin-1-yl]propyl]-5-(2-methylsulfonylethyl)-1H-indole Openeye Name: 3-[3-[4-(5-methoxypyrimidin-4-yl)-3-methyl-piperazin-1-yl]propyl]-5-(2-methylsulfonylethyl)-1H-indole CAS Name: 3-[3-[4-(5-methoxy-4-pyrimidinyl)-3-methyl-1-piperazinyl]propyl]-5-(2-methylsulfonylethyl)-1H-indole IUPAC Name: 3-[3-[4-(5-methoxypyrimidin-4-yl)-3-methylpiperazin-1-yl]propyl]-5-(2-methylsulfonylethyl)-1H-indole Traditional Name: 5-(2-mesylethyl)-3-[3-[4-(5-methoxypyrimidin-4-yl)-3-methyl-piperazino]propyl]-1H-indole Formula: C24H33N5O3S MolecularWeight: 471.61552

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=NC=NC=C2OC)CCCC3=CNC4=C3C=C(C=C4)CCS(=O)(=O)C

Isomeric SMILES

CC1CN(CCN1C2=NC=NC=C2OC)CCCC3=CNC4=C3C=C(C=C4)CCS(=O)(=O)C

InChI

InChI=1S/C24H33N5O3S/c1-18-16-28(10-11-29(18)24-23(32-2)15-25-17-27-24)9-4-5-20-14-26-22-7-6-19(13-21(20)22)8-12-33(3,30)31/h6-7,13-15,17-18,26H,4-5,8-12,16H2,1-3H3