N-[4-methyl-3-[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[4-methyl-3-[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]phenyl]cyclopropanecarboxamide Openeye Name: N-[4-methyl-3-[3-[4-(1-piperidylsulfonyl)phenyl]propanoylamino]phenyl]cyclopropanecarboxamide CAS Name: N-[4-methyl-3-[[1-oxo-3-[4-(1-piperidinylsulfonyl)phenyl]propyl]amino]phenyl]cyclopropanecarboxamide IUPAC Name: N-[4-methyl-3-[3-(4-piperidin-1-ylsulfonylphenyl)propanoylamino]phenyl]cyclopropanecarboxamide Traditional Name: N-[4-methyl-3-[3-(4-piperidinosulfonylphenyl)propanoylamino]phenyl]cyclopropanecarboxamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CC2)NC(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CC2)NC(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C25H31N3O4S/c1-18-5-11-21(26-25(30)20-9-10-20)17-23(18)27-24(29)14-8-19-6-12-22(13-7-19)33(31,32)28-15-3-2-4-16-28/h5-7,11-13,17,20H,2-4,8-10,14-16H2,1H3,(H,26,30)(H,27,29)