N-[2-(1H-indol-3-yl)ethyl]-4-[[(4-methylphenyl)sulfonylamino]methyl]cyclohexane-1-carboxamide

Systemtic Name: N-[2-(1H-indol-3-yl)ethyl]-4-[[(4-methylphenyl)sulfonylamino]methyl]cyclohexane-1-carboxamide Openeye Name: N-[2-(1H-indol-3-yl)ethyl]-4-[(p-tolylsulfonylamino)methyl]cyclohexanecarboxamide CAS Name: N-[2-(1H-indol-3-yl)ethyl]-4-[[(4-methylphenyl)sulfonylamino]methyl]-1-cyclohexanecarboxamide IUPAC Name: N-[2-(1H-indol-3-yl)ethyl]-4-[[(4-methylphenyl)sulfonylamino]methyl]cyclohexane-1-carboxamide Traditional Name: N-[2-(1H-indol-3-yl)ethyl]-4-[(tosylamino)methyl]cyclohexanecarboxamide Formula: C25H31N3O3S MolecularWeight: 453.59694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC2CCC(CC2)C(=O)NCCC3=CNC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC2CCC(CC2)C(=O)NCCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C25H31N3O3S/c1-18-6-12-22(13-7-18)32(30,31)28-16-19-8-10-20(11-9-19)25(29)26-15-14-21-17-27-24-5-3-2-4-23(21)24/h2-7,12-13,17,19-20,27-28H,8-11,14-16H2,1H3,(H,26,29)