(phenylmethyl) 2-[1-[[1-[3-[(E)-2-(7-chloranylquinolin-2-yl)ethenyl]phenyl]-2-[(4-chlorophenyl)sulfonylamino]ethyl]sulfanylmethyl]cyclopropyl]ethanoate

Systemtic Name: (phenylmethyl) 2-[1-[[1-[3-[(E)-2-(7-chloranylquinolin-2-yl)ethenyl]phenyl]-2-[(4-chlorophenyl)sulfonylamino]ethyl]sulfanylmethyl]cyclopropyl]ethanoate Openeye Name: benzyl 2-[1-[[2-[(4-chlorophenyl)sulfonylamino]-1-[3-[(E)-2-(7-chloro-2-quinolyl)vinyl]phenyl]ethyl]sulfanylmethyl]cyclopropyl]acetate CAS Name: 2-[1-[[[2-[(4-chlorophenyl)sulfonylamino]-1-[3-[(E)-2-(7-chloro-2-quinolinyl)ethenyl]phenyl]ethyl]thio]methyl]cyclopropyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[1-[[2-[(4-chlorophenyl)sulfonylamino]-1-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]phenyl]ethyl]sulfanylmethyl]cyclopropyl]acetate Traditional Name: 2-[1-[[[2-[(4-chlorophenyl)sulfonylamino]-1-[3-[(E)-2-(7-chloro-2-quinolyl)vinyl]phenyl]ethyl]thio]methyl]cyclopropyl]acetic acid benzyl ester Formula: C38H34Cl2N2O4S2 MolecularWeight: 717.72356

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(CC(=O)OCC2=CC=CC=C2)CSC(CNS(=O)(=O)C3=CC=C(C=C3)Cl)C4=CC=CC(=C4)C=CC5=NC6=C(C=CC(=C6)Cl)C=C5

Isomeric SMILES

C1CC1(CC(=O)OCC2=CC=CC=C2)CSC(CNS(=O)(=O)C3=CC=C(C=C3)Cl)C4=CC=CC(=C4)/C=C/C5=NC6=C(C=CC(=C6)Cl)C=C5

InChI

InChI=1S/C38H34Cl2N2O4S2/c39-31-13-17-34(18-14-31)48(44,45)41-24-36(47-26-38(19-20-38)23-37(43)46-25-28-5-2-1-3-6-28)30-8-4-7-27(21-30)9-15-33-16-11-29-10-12-32(40)22-35(29)42-33/h1-18,21-22,36,41H,19-20,23-26H2/b15-9+