(2S)-N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-2-methyl-2,3-dihydroindole-1-carbothioamide

Systemtic Name: (2S)-N-(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)-2-methyl-2,3-dihydroindole-1-carbothioamide Openeye Name: (2S)-N-(2-chloro-5-morpholinosulfonyl-phenyl)-2-methyl-indoline-1-carbothioamide CAS Name: (2S)-N-[2-chloro-5-(4-morpholinylsulfonyl)phenyl]-2-methyl-2,3-dihydroindole-1-carbothioamide IUPAC Name: (2S)-N-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-2-methyl-2,3-dihydroindole-1-carbothioamide Traditional Name: (2S)-N-(2-chloro-5-morpholinosulfonyl-phenyl)-2-methyl-indoline-1-carbothioamide Formula: C20H22ClN3O3S2 MolecularWeight: 451.98998

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=S)NC3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)Cl

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1C(=S)NC3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)Cl

InChI

InChI=1S/C20H22ClN3O3S2/c1-14-12-15-4-2-3-5-19(15)24(14)20(28)22-18-13-16(6-7-17(18)21)29(25,26)23-8-10-27-11-9-23/h2-7,13-14H,8-12H2,1H3,(H,22,28)/t14-/m0/s1