methyl (2S)-4-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethanoyl]thiomorpholine-2-carboxylate

Systemtic Name: methyl (2S)-4-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethanoyl]thiomorpholine-2-carboxylate Openeye Name: methyl (2S)-4-[2-[(2S)-2-methylindolin-1-yl]acetyl]thiomorpholine-2-carboxylate CAS Name: (2S)-4-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-oxoethyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-4-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetyl]thiomorpholine-2-carboxylate Traditional Name: (2S)-4-[2-[(2S)-2-methylindolin-1-yl]acetyl]thiomorpholine-2-carboxylic acid methyl ester Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1CC(=O)N3CCSC(C3)C(=O)OC

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1CC(=O)N3CCS[C@@H](C3)C(=O)OC

InChI

InChI=1S/C17H22N2O3S/c1-12-9-13-5-3-4-6-14(13)19(12)11-16(20)18-7-8-23-15(10-18)17(21)22-2/h3-6,12,15H,7-11H2,1-2H3/t12-,15-/m0/s1