N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C26H31N3O5S MolecularWeight: 497.60644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C(=O)C=CC3=CC=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CCN(CC2)C(=O)/C=C/C3=CC=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C26H31N3O5S/c1-20-7-9-23(19-24(20)35(32,33)29-15-17-34-18-16-29)27-26(31)22-11-13-28(14-12-22)25(30)10-8-21-5-3-2-4-6-21/h2-10,19,22H,11-18H2,1H3,(H,27,31)/b10-8+