4-(1-ethylindol-5-yl)sulfonyl-N-[2-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(1-ethylindol-5-yl)sulfonyl-N-[2-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide Openeye Name: 4-(1-ethylindol-5-yl)sulfonyl-N-[2-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide CAS Name: 4-[(1-ethyl-5-indolyl)sulfonyl]-N-[2-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide IUPAC Name: 4-(1-ethylindol-5-yl)sulfonyl-N-[2-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide Traditional Name: 4-(1-ethylindol-5-yl)sulfonyl-N-[2-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide Formula: C23H25F3N4O3S MolecularWeight: 494.52981

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCCN(CC3)C(=O)NC4=CC=CC=C4C(F)(F)F

Isomeric SMILES

CCN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCCN(CC3)C(=O)NC4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C23H25F3N4O3S/c1-2-28-13-10-17-16-18(8-9-21(17)28)34(32,33)30-12-5-11-29(14-15-30)22(31)27-20-7-4-3-6-19(20)23(24,25)26/h3-4,6-10,13,16H,2,5,11-12,14-15H2,1H3,(H,27,31)