N-[3-[[(4-azanylcyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]-4-chloranyl-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[[(4-azanylcyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]-4-chloranyl-phenyl]thiophene-2-carboxamide Openeye Name: N-[3-[[(4-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]-4-chloro-phenyl]thiophene-2-carboxamide CAS Name: N-[3-[[(4-aminocyclohexyl)-(3,3-dimethyl-1-oxobutyl)amino]methyl]-4-chlorophenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[[(4-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]-4-chlorophenyl]thiophene-2-carboxamide Traditional Name: N-[3-[[(4-aminocyclohexyl)-(3,3-dimethylbutanoyl)amino]methyl]-4-chloro-phenyl]thiophene-2-carboxamide Formula: C24H32ClN3O2S MolecularWeight: 462.04778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N(CC1=C(C=CC(=C1)NC(=O)C2=CC=CS2)Cl)C3CCC(CC3)N

Isomeric SMILES

CC(C)(C)CC(=O)N(CC1=C(C=CC(=C1)NC(=O)C2=CC=CS2)Cl)C3CCC(CC3)N

InChI

InChI=1S/C24H32ClN3O2S/c1-24(2,3)14-22(29)28(19-9-6-17(26)7-10-19)15-16-13-18(8-11-20(16)25)27-23(30)21-5-4-12-31-21/h4-5,8,11-13,17,19H,6-7,9-10,14-15,26H2,1-3H3,(H,27,30)