(2S,4R)-N-(1-benzothiophen-2-ylmethyl)-N-methyl-1-propan-2-yl-4-pyridin-2-ylsulfanyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S,4R)-N-(1-benzothiophen-2-ylmethyl)-N-methyl-1-propan-2-yl-4-pyridin-2-ylsulfanyl-pyrrolidine-2-carboxamide Openeye Name: (2S,4R)-N-(benzothiophen-2-ylmethyl)-1-isopropyl-N-methyl-4-(2-pyridylsulfanyl)pyrrolidine-2-carboxamide CAS Name: (2S,4R)-N-(1-benzothiophen-2-ylmethyl)-N-methyl-1-propan-2-yl-4-(2-pyridinylthio)-2-pyrrolidinecarboxamide IUPAC Name: (2S,4R)-N-(1-benzothiophen-2-ylmethyl)-N-methyl-1-propan-2-yl-4-pyridin-2-ylsulfanylpyrrolidine-2-carboxamide Traditional Name: (2S,4R)-N-(benzothiophen-2-ylmethyl)-1-isopropyl-N-methyl-4-(2-pyridylthio)pyrrolidine-2-carboxamide Formula: C23H27N3OS2 MolecularWeight: 425.60998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CC(CC1C(=O)N(C)CC2=CC3=CC=CC=C3S2)SC4=CC=CC=N4

Isomeric SMILES

CC(C)N1C[C@@H](C[C@H]1C(=O)N(C)CC2=CC3=CC=CC=C3S2)SC4=CC=CC=N4

InChI

InChI=1S/C23H27N3OS2/c1-16(2)26-15-19(29-22-10-6-7-11-24-22)13-20(26)23(27)25(3)14-18-12-17-8-4-5-9-21(17)28-18/h4-12,16,19-20H,13-15H2,1-3H3/t19-,20+/m1/s1