N-[5-(5-bromanyl-3-methyl-indol-1-yl)sulfonyl-2-methoxy-phenyl]-N',N'-dimethyl-propane-1,3-diamine

Systemtic Name: N-[5-(5-bromanyl-3-methyl-indol-1-yl)sulfonyl-2-methoxy-phenyl]-N',N'-dimethyl-propane-1,3-diamine Openeye Name: N-[5-(5-bromo-3-methyl-indol-1-yl)sulfonyl-2-methoxy-phenyl]-N',N'-dimethyl-propane-1,3-diamine CAS Name: N-[5-[(5-bromo-3-methyl-1-indolyl)sulfonyl]-2-methoxyphenyl]-N',N'-dimethylpropane-1,3-diamine IUPAC Name: N-[5-(5-bromo-3-methylindol-1-yl)sulfonyl-2-methoxyphenyl]-N',N'-dimethylpropane-1,3-diamine Traditional Name: 3-[5-(5-bromo-3-methyl-indol-1-yl)sulfonyl-2-methoxy-anilino]propyl-dimethyl-amine Formula: C21H26BrN3O3S MolecularWeight: 480.41844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C2=C1C=C(C=C2)Br)S(=O)(=O)C3=CC(=C(C=C3)OC)NCCCN(C)C

Isomeric SMILES

CC1=CN(C2=C1C=C(C=C2)Br)S(=O)(=O)C3=CC(=C(C=C3)OC)NCCCN(C)C

InChI

InChI=1S/C21H26BrN3O3S/c1-15-14-25(20-8-6-16(22)12-18(15)20)29(26,27)17-7-9-21(28-4)19(13-17)23-10-5-11-24(2)3/h6-9,12-14,23H,5,10-11H2,1-4H3