N-[4-[4-[2-[2-(3,5-dimethylphenyl)-5-(2-methyl-1-morpholin-4-yl-1-oxidanylidene-propan-2-yl)-1H-indol-3-yl]ethylamino]butyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[4-[2-[2-(3,5-dimethylphenyl)-5-(2-methyl-1-morpholin-4-yl-1-oxidanylidene-propan-2-yl)-1H-indol-3-yl]ethylamino]butyl]phenyl]methanesulfonamide Openeye Name: N-[4-[4-[2-[5-(1,1-dimethyl-2-morpholino-2-oxo-ethyl)-2-(3,5-dimethylphenyl)-1H-indol-3-yl]ethylamino]butyl]phenyl]methanesulfonamide CAS Name: N-[4-[4-[2-[2-(3,5-dimethylphenyl)-5-[2-methyl-1-(4-morpholinyl)-1-oxopropan-2-yl]-1H-indol-3-yl]ethylamino]butyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[4-[2-[2-(3,5-dimethylphenyl)-5-(2-methyl-1-morpholin-4-yl-1-oxopropan-2-yl)-1H-indol-3-yl]ethylamino]butyl]phenyl]methanesulfonamide Traditional Name: N-[4-[4-[2-[2-(3,5-dimethylphenyl)-5-(2-keto-1,1-dimethyl-2-morpholino-ethyl)-1H-indol-3-yl]ethylamino]butyl]phenyl]methanesulfonamide Formula: C37H48N4O4S MolecularWeight: 644.86642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)C(C)(C)C(=O)N4CCOCC4)CCNCCCCC5=CC=C(C=C5)NS(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)C(C)(C)C(=O)N4CCOCC4)CCNCCCCC5=CC=C(C=C5)NS(=O)(=O)C)C

InChI

InChI=1S/C37H48N4O4S/c1-26-22-27(2)24-29(23-26)35-32(15-17-38-16-7-6-8-28-9-12-31(13-10-28)40-46(5,43)44)33-25-30(11-14-34(33)39-35)37(3,4)36(42)41-18-20-45-21-19-41/h9-14,22-25,38-40H,6-8,15-21H2,1-5H3