(Z)-6-[4-[(4-chlorophenyl)sulfonyl-propan-2-yl-amino]phenyl]-6-pyridin-3-yl-hex-5-enoic acid

Systemtic Name: (Z)-6-[4-[(4-chlorophenyl)sulfonyl-propan-2-yl-amino]phenyl]-6-pyridin-3-yl-hex-5-enoic acid Openeye Name: (Z)-6-[4-[(4-chlorophenyl)sulfonyl-isopropyl-amino]phenyl]-6-(3-pyridyl)hex-5-enoic acid CAS Name: (Z)-6-[4-[(4-chlorophenyl)sulfonyl-propan-2-ylamino]phenyl]-6-(3-pyridinyl)-5-hexenoic acid IUPAC Name: (Z)-6-[4-[(4-chlorophenyl)sulfonyl-propan-2-ylamino]phenyl]-6-pyridin-3-ylhex-5-enoic acid Traditional Name: (Z)-6-[4-[(4-chlorophenyl)sulfonyl-isopropyl-amino]phenyl]-6-(3-pyridyl)hex-5-enoic acid Formula: C26H27ClN2O4S MolecularWeight: 499.02158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=C(C=C1)C(=CCCCC(=O)O)C2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)N(C1=CC=C(C=C1)/C(=C/CCCC(=O)O)/C2=CN=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C26H27ClN2O4S/c1-19(2)29(34(32,33)24-15-11-22(27)12-16-24)23-13-9-20(10-14-23)25(7-3-4-8-26(30)31)21-6-5-17-28-18-21/h5-7,9-19H,3-4,8H2,1-2H3,(H,30,31)/b25-7-