N-[5-chloranyl-3-(phenylsulfonyl)-1H-indol-2-yl]-2-[(3-methyloxetan-3-yl)methylamino]ethanamide

Systemtic Name: N-[5-chloranyl-3-(phenylsulfonyl)-1H-indol-2-yl]-2-[(3-methyloxetan-3-yl)methylamino]ethanamide Openeye Name: N-[3-(benzenesulfonyl)-5-chloro-1H-indol-2-yl]-2-[(3-methyloxetan-3-yl)methylamino]acetamide CAS Name: N-[3-(benzenesulfonyl)-5-chloro-1H-indol-2-yl]-2-[(3-methyl-3-oxetanyl)methylamino]acetamide IUPAC Name: N-[3-(benzenesulfonyl)-5-chloro-1H-indol-2-yl]-2-[(3-methyloxetan-3-yl)methylamino]acetamide Traditional Name: N-(3-besyl-5-chloro-1H-indol-2-yl)-2-[(3-methyloxetan-3-yl)methylamino]acetamide Formula: C21H22ClN3O4S MolecularWeight: 447.93508

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC1)CNCC(=O)NC2=C(C3=C(N2)C=CC(=C3)Cl)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1(COC1)CNCC(=O)NC2=C(C3=C(N2)C=CC(=C3)Cl)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H22ClN3O4S/c1-21(12-29-13-21)11-23-10-18(26)25-20-19(16-9-14(22)7-8-17(16)24-20)30(27,28)15-5-3-2-4-6-15/h2-9,23-24H,10-13H2,1H3,(H,25,26)