N-[5-[[2,5-bis(chloranyl)phenyl]methyl]-1,3-thiazol-2-yl]-2-cyano-3-(4-pentoxyphenyl)prop-2-enamide

Systemtic Name: N-[5-[[2,5-bis(chloranyl)phenyl]methyl]-1,3-thiazol-2-yl]-2-cyano-3-(4-pentoxyphenyl)prop-2-enamide Openeye Name: 2-cyano-N-[5-[(2,5-dichlorophenyl)methyl]thiazol-2-yl]-3-(4-pentoxyphenyl)prop-2-enamide CAS Name: 2-cyano-N-[5-[(2,5-dichlorophenyl)methyl]-2-thiazolyl]-3-(4-pentoxyphenyl)-2-propenamide IUPAC Name: 2-cyano-N-[5-[(2,5-dichlorophenyl)methyl]-1,3-thiazol-2-yl]-3-(4-pentoxyphenyl)prop-2-enamide Traditional Name: 3-(4-amoxyphenyl)-2-cyano-N-[5-(2,5-dichlorobenzyl)thiazol-2-yl]acrylamide Formula: C25H23Cl2N3O2S MolecularWeight: 500.44002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC=C(S2)CC3=C(C=CC(=C3)Cl)Cl

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC=C(S2)CC3=C(C=CC(=C3)Cl)Cl

InChI

InChI=1S/C25H23Cl2N3O2S/c1-2-3-4-11-32-21-8-5-17(6-9-21)12-19(15-28)24(31)30-25-29-16-22(33-25)14-18-13-20(26)7-10-23(18)27/h5-10,12-13,16H,2-4,11,14H2,1H3,(H,29,30,31)