2-[butylcarbamoyl(cyclohexyl)amino]-N-[(5-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[butylcarbamoyl(cyclohexyl)amino]-N-[(5-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[butylcarbamoyl(cyclohexyl)amino]-N-[(5-methyl-2-thienyl)methyl]acetamide CAS Name: 2-[[butylamino(oxo)methyl]-cyclohexylamino]-N-[(5-methyl-2-thiophenyl)methyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[butylcarbamoyl(cyclohexyl)amino]-N-[(5-methylthiophen-2-yl)methyl]acetamide Traditional Name: N-benzyl-2-[butylcarbamoyl(cyclohexyl)amino]-N-[(5-methyl-2-thienyl)methyl]acetamide Formula: C26H37N3O2S MolecularWeight: 455.65588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N(CC(=O)N(CC1=CC=CC=C1)CC2=CC=C(S2)C)C3CCCCC3

Isomeric SMILES

CCCCNC(=O)N(CC(=O)N(CC1=CC=CC=C1)CC2=CC=C(S2)C)C3CCCCC3

InChI

InChI=1S/C26H37N3O2S/c1-3-4-17-27-26(31)29(23-13-9-6-10-14-23)20-25(30)28(18-22-11-7-5-8-12-22)19-24-16-15-21(2)32-24/h5,7-8,11-12,15-16,23H,3-4,6,9-10,13-14,17-20H2,1-2H3,(H,27,31)