[1-methylsulfonyl-6-[5-(2-phenoxyethylsulfanylmethyl)-1,3,4-oxadiazol-2-yl]indol-2-yl]methanamine

Systemtic Name: [1-methylsulfonyl-6-[5-(2-phenoxyethylsulfanylmethyl)-1,3,4-oxadiazol-2-yl]indol-2-yl]methanamine Openeye Name: [1-methylsulfonyl-6-[5-(2-phenoxyethylsulfanylmethyl)-1,3,4-oxadiazol-2-yl]indol-2-yl]methanamine CAS Name: [1-methylsulfonyl-6-[5-[(2-phenoxyethylthio)methyl]-1,3,4-oxadiazol-2-yl]-2-indolyl]methanamine IUPAC Name: [1-methylsulfonyl-6-[5-(2-phenoxyethylsulfanylmethyl)-1,3,4-oxadiazol-2-yl]indol-2-yl]methanamine Traditional Name: [1-mesyl-6-[5-[(2-phenoxyethylthio)methyl]-1,3,4-oxadiazol-2-yl]indol-2-yl]methylamine Formula: C21H22N4O4S2 MolecularWeight: 458.55378

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1C(=CC2=C1C=C(C=C2)C3=NN=C(O3)CSCCOC4=CC=CC=C4)CN

Isomeric SMILES

CS(=O)(=O)N1C(=CC2=C1C=C(C=C2)C3=NN=C(O3)CSCCOC4=CC=CC=C4)CN

InChI

InChI=1S/C21H22N4O4S2/c1-31(26,27)25-17(13-22)11-15-7-8-16(12-19(15)25)21-24-23-20(29-21)14-30-10-9-28-18-5-3-2-4-6-18/h2-8,11-12H,9-10,13-14,22H2,1H3