(Z)-3-[2-[(3-chloranylpyridin-2-yl)methylsulfanyl]ethylamino]-3-[2-(1,2-oxazol-3-ylmethylsulfanyl)ethylamino]-2-(phenylsulfonyl)prop-2-enenitrile

Systemtic Name: (Z)-3-[2-[(3-chloranylpyridin-2-yl)methylsulfanyl]ethylamino]-3-[2-(1,2-oxazol-3-ylmethylsulfanyl)ethylamino]-2-(phenylsulfonyl)prop-2-enenitrile Openeye Name: (Z)-2-(benzenesulfonyl)-3-[2-[(3-chloro-2-pyridyl)methylsulfanyl]ethylamino]-3-[2-(isoxazol-3-ylmethylsulfanyl)ethylamino]prop-2-enenitrile CAS Name: (Z)-2-(benzenesulfonyl)-3-[2-[(3-chloro-2-pyridinyl)methylthio]ethylamino]-3-[2-(3-isoxazolylmethylthio)ethylamino]-2-propenenitrile IUPAC Name: (Z)-2-(benzenesulfonyl)-3-[2-[(3-chloropyridin-2-yl)methylsulfanyl]ethylamino]-3-[2-(1,2-oxazol-3-ylmethylsulfanyl)ethylamino]prop-2-enenitrile Traditional Name: (Z)-2-besyl-3-[2-[(3-chloro-2-pyridyl)methylthio]ethylamino]-3-[2-(isoxazol-3-ylmethylthio)ethylamino]acrylonitrile Formula: C23H24ClN5O3S3 MolecularWeight: 550.11636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C(=C(NCCSCC2=NOC=C2)NCCSCC3=C(C=CC=N3)Cl)C#N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)/C(=C(\NCCSCC2=NOC=C2)/NCCSCC3=C(C=CC=N3)Cl)/C#N

InChI

InChI=1S/C23H24ClN5O3S3/c24-20-7-4-9-26-21(20)17-34-14-11-28-23(27-10-13-33-16-18-8-12-32-29-18)22(15-25)35(30,31)19-5-2-1-3-6-19/h1-9,12,27-28H,10-11,13-14,16-17H2/b23-22+