4-methyl-N-[(2S)-3-methyl-1-oxidanylidene-1-[(5-piperidin-1-ylsulfonylthiophen-2-yl)methylamino]butan-2-yl]benzamide

Systemtic Name: 4-methyl-N-[(2S)-3-methyl-1-oxidanylidene-1-[(5-piperidin-1-ylsulfonylthiophen-2-yl)methylamino]butan-2-yl]benzamide Openeye Name: 4-methyl-N-[(1S)-2-methyl-1-[[5-(1-piperidylsulfonyl)-2-thienyl]methylcarbamoyl]propyl]benzamide CAS Name: 4-methyl-N-[(2S)-3-methyl-1-oxo-1-[[5-(1-piperidinylsulfonyl)-2-thiophenyl]methylamino]butan-2-yl]benzamide IUPAC Name: 4-methyl-N-[(2S)-3-methyl-1-oxo-1-[(5-piperidin-1-ylsulfonylthiophen-2-yl)methylamino]butan-2-yl]benzamide Traditional Name: 4-methyl-N-[(1S)-2-methyl-1-[(5-piperidinosulfonyl-2-thienyl)methylcarbamoyl]propyl]benzamide Formula: C23H31N3O4S2 MolecularWeight: 477.63994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N[C@@H](C(C)C)C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C23H31N3O4S2/c1-16(2)21(25-22(27)18-9-7-17(3)8-10-18)23(28)24-15-19-11-12-20(31-19)32(29,30)26-13-5-4-6-14-26/h7-12,16,21H,4-6,13-15H2,1-3H3,(H,24,28)(H,25,27)/t21-/m0/s1