N-[[2-[[methyl(propan-2-yl)amino]methyl]phenyl]methyl]-3-piperidin-1-ylsulfonyl-thiophene-2-carboxamide

Systemtic Name: N-[[2-[[methyl(propan-2-yl)amino]methyl]phenyl]methyl]-3-piperidin-1-ylsulfonyl-thiophene-2-carboxamide Openeye Name: N-[[2-[[isopropyl(methyl)amino]methyl]phenyl]methyl]-3-(1-piperidylsulfonyl)thiophene-2-carboxamide CAS Name: N-[[2-[[methyl(propan-2-yl)amino]methyl]phenyl]methyl]-3-(1-piperidinylsulfonyl)-2-thiophenecarboxamide IUPAC Name: N-[[2-[[methyl(propan-2-yl)amino]methyl]phenyl]methyl]-3-piperidin-1-ylsulfonylthiophene-2-carboxamide Traditional Name: N-[2-[[isopropyl(methyl)amino]methyl]benzyl]-3-piperidinosulfonyl-thiophene-2-carboxamide Formula: C22H31N3O3S2 MolecularWeight: 449.62984

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C)CC1=CC=CC=C1CNC(=O)C2=C(C=CS2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)N(C)CC1=CC=CC=C1CNC(=O)C2=C(C=CS2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H31N3O3S2/c1-17(2)24(3)16-19-10-6-5-9-18(19)15-23-22(26)21-20(11-14-29-21)30(27,28)25-12-7-4-8-13-25/h5-6,9-11,14,17H,4,7-8,12-13,15-16H2,1-3H3,(H,23,26)