2-(1-adamantyl)-N-[3-cyano-4-(2,4-dichlorophenyl)-5-methyl-thiophen-2-yl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[3-cyano-4-(2,4-dichlorophenyl)-5-methyl-thiophen-2-yl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[3-cyano-4-(2,4-dichlorophenyl)-5-methyl-2-thienyl]acetamide CAS Name: 2-(1-adamantyl)-N-[3-cyano-4-(2,4-dichlorophenyl)-5-methyl-2-thiophenyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[3-cyano-4-(2,4-dichlorophenyl)-5-methylthiophen-2-yl]acetamide Traditional Name: 2-(1-adamantyl)-N-[3-cyano-4-(2,4-dichlorophenyl)-5-methyl-2-thienyl]acetamide Formula: C24H24Cl2N2OS MolecularWeight: 459.43116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)CC23CC4CC(C2)CC(C4)C3)C#N)C5=C(C=C(C=C5)Cl)Cl

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)CC23CC4CC(C2)CC(C4)C3)C#N)C5=C(C=C(C=C5)Cl)Cl

InChI

InChI=1S/C24H24Cl2N2OS/c1-13-22(18-3-2-17(25)7-20(18)26)19(12-27)23(30-13)28-21(29)11-24-8-14-4-15(9-24)6-16(5-14)10-24/h2-3,7,14-16H,4-6,8-11H2,1H3,(H,28,29)