(3R)-1-[[3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-yl]carbonyl]piperidine-3-carboxamide

Systemtic Name: (3R)-1-[[3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-yl]carbonyl]piperidine-3-carboxamide Openeye Name: (3R)-1-[3-[(4-methylthiazol-2-yl)sulfanylmethyl]benzofuran-2-carbonyl]piperidine-3-carboxamide CAS Name: (3R)-1-[[3-[[(4-methyl-2-thiazolyl)thio]methyl]-2-benzofuranyl]-oxomethyl]-3-piperidinecarboxamide IUPAC Name: (3R)-1-[3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-carbonyl]piperidine-3-carboxamide Traditional Name: (3R)-1-[3-[[(4-methylthiazol-2-yl)thio]methyl]benzofuran-2-carbonyl]nipecotamide Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SCC2=C(OC3=CC=CC=C32)C(=O)N4CCCC(C4)C(=O)N

Isomeric SMILES

CC1=CSC(=N1)SCC2=C(OC3=CC=CC=C32)C(=O)N4CCC[C@H](C4)C(=O)N

InChI

InChI=1S/C20H21N3O3S2/c1-12-10-27-20(22-12)28-11-15-14-6-2-3-7-16(14)26-17(15)19(25)23-8-4-5-13(9-23)18(21)24/h2-3,6-7,10,13H,4-5,8-9,11H2,1H3,(H2,21,24)/t13-/m1/s1