(E)-3-[3,5-bis(chloranyl)-2-methoxy-phenyl]-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)prop-2-enamide

Systemtic Name: (E)-3-[3,5-bis(chloranyl)-2-methoxy-phenyl]-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)prop-2-enamide Openeye Name: (E)-N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(3,5-dichloro-2-methoxy-phenyl)prop-2-enamide CAS Name: (E)-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3,5-dichloro-2-methoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3,5-dichloro-2-methoxyphenyl)prop-2-enamide Traditional Name: (E)-N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(3,5-dichloro-2-methoxy-phenyl)acrylamide Formula: C20H18Cl2N2O2S MolecularWeight: 421.34012

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C=CC3=CC(=CC(=C3OC)Cl)Cl

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)/C=C/C3=CC(=CC(=C3OC)Cl)Cl

InChI

InChI=1S/C20H18Cl2N2O2S/c1-11-3-5-14-15(10-23)20(27-17(14)7-11)24-18(25)6-4-12-8-13(21)9-16(22)19(12)26-2/h4,6,8-9,11H,3,5,7H2,1-2H3,(H,24,25)/b6-4+