N-[2-butyl-1-[2-[methyl-(phenylmethyl)amino]ethyl]indol-5-yl]-4-propan-2-yl-benzamide sulfate

Systemtic Name: N-[2-butyl-1-[2-[methyl-(phenylmethyl)amino]ethyl]indol-5-yl]-4-propan-2-yl-benzamide sulfate Openeye Name: N-[1-[2-[benzyl(methyl)amino]ethyl]-2-butyl-indol-5-yl]-4-isopropyl-benzamide sulfate CAS Name: N-[2-butyl-1-[2-[methyl-(phenylmethyl)amino]ethyl]-5-indolyl]-4-propan-2-ylbenzamide sulfate IUPAC Name: N-[1-[2-[benzyl(methyl)amino]ethyl]-2-butylindol-5-yl]-4-propan-2-ylbenzamide sulfate Traditional Name: N-[1-[2-[benzyl(methyl)amino]ethyl]-2-butyl-indol-5-yl]-4-isopropyl-benzamide sulfate Formula: C32H39N3O5S-2 MolecularWeight: 577.73416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(N1CCN(C)CC3=CC=CC=C3)C=CC(=C2)NC(=O)C4=CC=C(C=C4)C(C)C.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CCCCC1=CC2=C(N1CCN(C)CC3=CC=CC=C3)C=CC(=C2)NC(=O)C4=CC=C(C=C4)C(C)C.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C32H39N3O.H2O4S/c1-5-6-12-30-22-28-21-29(33-32(36)27-15-13-26(14-16-27)24(2)3)17-18-31(28)35(30)20-19-34(4)23-25-10-8-7-9-11-25;1-5(2,3)4/h7-11,13-18,21-22,24H,5-6,12,19-20,23H2,1-4H3,(H,33,36);(H2,1,2,3,4)/p-2