ethyl 1-[3-[2-phenylazanyl-3-(3-propan-2-yloxypropyl)imidazol-4-yl]phenyl]sulfonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-[2-phenylazanyl-3-(3-propan-2-yloxypropyl)imidazol-4-yl]phenyl]sulfonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[3-[2-anilino-3-(3-isopropoxypropyl)imidazol-4-yl]phenyl]sulfonylpiperidine-4-carboxylate CAS Name: 1-[3-[2-anilino-3-(3-propan-2-yloxypropyl)-4-imidazolyl]phenyl]sulfonyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[2-anilino-3-(3-propan-2-yloxypropyl)imidazol-4-yl]phenyl]sulfonylpiperidine-4-carboxylate Traditional Name: 1-[3-[2-anilino-3-(3-isopropoxypropyl)imidazol-4-yl]phenyl]sulfonylisonipecotic acid ethyl ester Formula: C29H38N4O5S MolecularWeight: 554.70082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=CN=C(N3CCCOC(C)C)NC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C3=CN=C(N3CCCOC(C)C)NC4=CC=CC=C4

InChI

InChI=1S/C29H38N4O5S/c1-4-37-28(34)23-14-17-32(18-15-23)39(35,36)26-13-8-10-24(20-26)27-21-30-29(31-25-11-6-5-7-12-25)33(27)16-9-19-38-22(2)3/h5-8,10-13,20-23H,4,9,14-19H2,1-3H3,(H,30,31)