(2S,4R)-N-cyclopropyl-1-[(3-methoxy-2-oxidanyl-phenyl)methyl]-4-(4-methoxyphenyl)sulfanyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S,4R)-N-cyclopropyl-1-[(3-methoxy-2-oxidanyl-phenyl)methyl]-4-(4-methoxyphenyl)sulfanyl-pyrrolidine-2-carboxamide Openeye Name: (2S,4R)-N-cyclopropyl-1-[(2-hydroxy-3-methoxy-phenyl)methyl]-4-(4-methoxyphenyl)sulfanyl-pyrrolidine-2-carboxamide CAS Name: (2S,4R)-N-cyclopropyl-1-[(2-hydroxy-3-methoxyphenyl)methyl]-4-[(4-methoxyphenyl)thio]-2-pyrrolidinecarboxamide IUPAC Name: (2S,4R)-N-cyclopropyl-1-[(2-hydroxy-3-methoxyphenyl)methyl]-4-(4-methoxyphenyl)sulfanylpyrrolidine-2-carboxamide Traditional Name: (2S,4R)-N-cyclopropyl-1-(2-hydroxy-3-methoxy-benzyl)-4-[(4-methoxyphenyl)thio]pyrrolidine-2-carboxamide Formula: C23H28N2O4S MolecularWeight: 428.54442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SC2CC(N(C2)CC3=C(C(=CC=C3)OC)O)C(=O)NC4CC4

Isomeric SMILES

COC1=CC=C(C=C1)S[C@@H]2C[C@H](N(C2)CC3=C(C(=CC=C3)OC)O)C(=O)NC4CC4

InChI

InChI=1S/C23H28N2O4S/c1-28-17-8-10-18(11-9-17)30-19-12-20(23(27)24-16-6-7-16)25(14-19)13-15-4-3-5-21(29-2)22(15)26/h3-5,8-11,16,19-20,26H,6-7,12-14H2,1-2H3,(H,24,27)/t19-,20+/m1/s1