ethyl 2-[[3-chloranyl-4-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]oxy-phenyl]-[(E)-3-(3-cyanophenyl)prop-2-enyl]sulfamoyl]ethanoate

Systemtic Name: ethyl 2-[[3-chloranyl-4-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]oxy-phenyl]-[(E)-3-(3-cyanophenyl)prop-2-enyl]sulfamoyl]ethanoate Openeye Name: ethyl 2-[[3-chloro-4-[[1-[2-(2-pyridyl)ethyl]-4-piperidyl]oxy]phenyl]-[(E)-3-(3-cyanophenyl)allyl]sulfamoyl]acetate CAS Name: 2-[[3-chloro-4-[[1-[2-(2-pyridinyl)ethyl]-4-piperidinyl]oxy]phenyl]-[(E)-3-(3-cyanophenyl)prop-2-enyl]sulfamoyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[[3-chloro-4-[1-(2-pyridin-2-ylethyl)piperidin-4-yl]oxyphenyl]-[(E)-3-(3-cyanophenyl)prop-2-enyl]sulfamoyl]acetate Traditional Name: 2-[[3-chloro-4-[[1-[2-(2-pyridyl)ethyl]-4-piperidyl]oxy]phenyl]-[(E)-3-(3-cyanophenyl)allyl]sulfamoyl]acetic acid ethyl ester Formula: C32H35ClN4O5S MolecularWeight: 623.1621

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CS(=O)(=O)N(CC=CC1=CC=CC(=C1)C#N)C2=CC(=C(C=C2)OC3CCN(CC3)CCC4=CC=CC=N4)Cl

Isomeric SMILES

CCOC(=O)CS(=O)(=O)N(C/C=C/C1=CC=CC(=C1)C#N)C2=CC(=C(C=C2)OC3CCN(CC3)CCC4=CC=CC=N4)Cl

InChI

InChI=1S/C32H35ClN4O5S/c1-2-41-32(38)24-43(39,40)37(17-6-9-25-7-5-8-26(21-25)23-34)28-11-12-31(30(33)22-28)42-29-14-19-36(20-15-29)18-13-27-10-3-4-16-35-27/h3-12,16,21-22,29H,2,13-15,17-20,24H2,1H3/b9-6+