3-(diethylamino)-N-[(1R)-3-phenyl-1-(3-thiophen-3-yl-1H-1,2,4-triazol-5-yl)propyl]propane-1-sulfonamide

Systemtic Name: 3-(diethylamino)-N-[(1R)-3-phenyl-1-(3-thiophen-3-yl-1H-1,2,4-triazol-5-yl)propyl]propane-1-sulfonamide Openeye Name: 3-(diethylamino)-N-[(1R)-3-phenyl-1-[3-(3-thienyl)-1H-1,2,4-triazol-5-yl]propyl]propane-1-sulfonamide CAS Name: 3-(diethylamino)-N-[(1R)-3-phenyl-1-[3-(3-thiophenyl)-1H-1,2,4-triazol-5-yl]propyl]-1-propanesulfonamide IUPAC Name: 3-(diethylamino)-N-[(1R)-3-phenyl-1-(3-thiophen-3-yl-1H-1,2,4-triazol-5-yl)propyl]propane-1-sulfonamide Traditional Name: 3-(diethylamino)-N-[(1R)-3-phenyl-1-[3-(3-thienyl)-1H-1,2,4-triazol-5-yl]propyl]propane-1-sulfonamide Formula: C22H31N5O2S2 MolecularWeight: 461.64384

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCS(=O)(=O)NC(CCC1=CC=CC=C1)C2=NC(=NN2)C3=CSC=C3

Isomeric SMILES

CCN(CC)CCCS(=O)(=O)N[C@H](CCC1=CC=CC=C1)C2=NC(=NN2)C3=CSC=C3

InChI

InChI=1S/C22H31N5O2S2/c1-3-27(4-2)14-8-16-31(28,29)26-20(12-11-18-9-6-5-7-10-18)22-23-21(24-25-22)19-13-15-30-17-19/h5-7,9-10,13,15,17,20,26H,3-4,8,11-12,14,16H2,1-2H3,(H,23,24,25)/t20-/m1/s1