(3S)-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-1-(2-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-1-(2-methoxyphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-1-(2-methoxyphenyl)-5-oxo-N-[(4S)-thiochroman-4-yl]pyrrolidine-3-carboxamide CAS Name: (3S)-N-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]-1-(2-methoxyphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-1-(2-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-5-keto-1-(2-methoxyphenyl)-N-[(4S)-thiochroman-4-yl]pyrrolidine-3-carboxamide Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC(CC2=O)C(=O)NC3CCSC4=CC=CC=C34

Isomeric SMILES

COC1=CC=CC=C1N2C[C@H](CC2=O)C(=O)N[C@H]3CCSC4=CC=CC=C34

InChI

InChI=1S/C21H22N2O3S/c1-26-18-8-4-3-7-17(18)23-13-14(12-20(23)24)21(25)22-16-10-11-27-19-9-5-2-6-15(16)19/h2-9,14,16H,10-13H2,1H3,(H,22,25)/t14-,16-/m0/s1