N-[(2R)-3-methyl-1-[[(2R)-2-(4-methylpiperidin-1-yl)-2-thiophen-2-yl-ethyl]amino]-1-oxidanylidene-butan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2R)-3-methyl-1-[[(2R)-2-(4-methylpiperidin-1-yl)-2-thiophen-2-yl-ethyl]amino]-1-oxidanylidene-butan-2-yl]furan-2-carboxamide Openeye Name: N-[(1R)-2-methyl-1-[[(2R)-2-(4-methyl-1-piperidyl)-2-(2-thienyl)ethyl]carbamoyl]propyl]furan-2-carboxamide CAS Name: N-[(2R)-3-methyl-1-[[(2R)-2-(4-methyl-1-piperidinyl)-2-thiophen-2-ylethyl]amino]-1-oxobutan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2R)-3-methyl-1-[[(2R)-2-(4-methylpiperidin-1-yl)-2-thiophen-2-ylethyl]amino]-1-oxobutan-2-yl]furan-2-carboxamide Traditional Name: N-[(1R)-2-methyl-1-[[(2R)-2-(4-methylpiperidino)-2-(2-thienyl)ethyl]carbamoyl]propyl]-2-furamide Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(CNC(=O)C(C(C)C)NC(=O)C2=CC=CO2)C3=CC=CS3

Isomeric SMILES

CC1CCN(CC1)[C@H](CNC(=O)[C@@H](C(C)C)NC(=O)C2=CC=CO2)C3=CC=CS3

InChI

InChI=1S/C22H31N3O3S/c1-15(2)20(24-21(26)18-6-4-12-28-18)22(27)23-14-17(19-7-5-13-29-19)25-10-8-16(3)9-11-25/h4-7,12-13,15-17,20H,8-11,14H2,1-3H3,(H,23,27)(H,24,26)/t17-,20-/m1/s1