N-(3-imidazol-1-ylpropyl)-2-[3-[(2-methylphenyl)methylsulfonyl]indol-1-yl]ethanamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-2-[3-[(2-methylphenyl)methylsulfonyl]indol-1-yl]ethanamide Openeye Name: N-(3-imidazol-1-ylpropyl)-2-[3-(o-tolylmethylsulfonyl)indol-1-yl]acetamide CAS Name: N-[3-(1-imidazolyl)propyl]-2-[3-[(2-methylphenyl)methylsulfonyl]-1-indolyl]acetamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-2-[3-[(2-methylphenyl)methylsulfonyl]indol-1-yl]acetamide Traditional Name: N-(3-imidazol-1-ylpropyl)-2-[3-(2-methylbenzyl)sulfonylindol-1-yl]acetamide Formula: C24H26N4O3S MolecularWeight: 450.55324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CS(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)NCCCN4C=CN=C4

Isomeric SMILES

CC1=CC=CC=C1CS(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)NCCCN4C=CN=C4

InChI

InChI=1S/C24H26N4O3S/c1-19-7-2-3-8-20(19)17-32(30,31)23-15-28(22-10-5-4-9-21(22)23)16-24(29)26-11-6-13-27-14-12-25-18-27/h2-5,7-10,12,14-15,18H,6,11,13,16-17H2,1H3,(H,26,29)