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

Systemtic Name: N-[2-methoxy-5-(3-methylindol-1-yl)sulfonyl-phenyl]-N',N'-dimethyl-propane-1,3-diamine Openeye Name: N-[2-methoxy-5-(3-methylindol-1-yl)sulfonyl-phenyl]-N',N'-dimethyl-propane-1,3-diamine CAS Name: N-[2-methoxy-5-[(3-methyl-1-indolyl)sulfonyl]phenyl]-N',N'-dimethylpropane-1,3-diamine IUPAC Name: N-[2-methoxy-5-(3-methylindol-1-yl)sulfonylphenyl]-N',N'-dimethylpropane-1,3-diamine Traditional Name: 3-[2-methoxy-5-(3-methylindol-1-yl)sulfonyl-anilino]propyl-dimethyl-amine Formula: C21H27N3O3S MolecularWeight: 401.52238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C2=CC=CC=C12)S(=O)(=O)C3=CC(=C(C=C3)OC)NCCCN(C)C

Isomeric SMILES

CC1=CN(C2=CC=CC=C12)S(=O)(=O)C3=CC(=C(C=C3)OC)NCCCN(C)C

InChI

InChI=1S/C21H27N3O3S/c1-16-15-24(20-9-6-5-8-18(16)20)28(25,26)17-10-11-21(27-4)19(14-17)22-12-7-13-23(2)3/h5-6,8-11,14-15,22H,7,12-13H2,1-4H3