N-[5-(3-bromanylindol-1-yl)sulfonyl-2-methoxy-phenyl]-1-methyl-piperidin-4-amine

Systemtic Name: N-[5-(3-bromanylindol-1-yl)sulfonyl-2-methoxy-phenyl]-1-methyl-piperidin-4-amine Openeye Name: N-[5-(3-bromoindol-1-yl)sulfonyl-2-methoxy-phenyl]-1-methyl-piperidin-4-amine CAS Name: N-[5-[(3-bromo-1-indolyl)sulfonyl]-2-methoxyphenyl]-1-methyl-4-piperidinamine IUPAC Name: N-[5-(3-bromoindol-1-yl)sulfonyl-2-methoxyphenyl]-1-methylpiperidin-4-amine Traditional Name: [5-(3-bromoindol-1-yl)sulfonyl-2-methoxy-phenyl]-(1-methyl-4-piperidyl)amine Formula: C21H24BrN3O3S MolecularWeight: 478.40256

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)NC2=C(C=CC(=C2)S(=O)(=O)N3C=C(C4=CC=CC=C43)Br)OC

Isomeric SMILES

CN1CCC(CC1)NC2=C(C=CC(=C2)S(=O)(=O)N3C=C(C4=CC=CC=C43)Br)OC

InChI

InChI=1S/C21H24BrN3O3S/c1-24-11-9-15(10-12-24)23-19-13-16(7-8-21(19)28-2)29(26,27)25-14-18(22)17-5-3-4-6-20(17)25/h3-8,13-15,23H,9-12H2,1-2H3