2-[butan-2-yl(cyclohexylcarbamoyl)amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[butan-2-yl(cyclohexylcarbamoyl)amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-benzyl-2-[cyclohexylcarbamoyl(sec-butyl)amino]-N-(2-thienylmethyl)acetamide CAS Name: 2-[butan-2-yl-[(cyclohexylamino)-oxomethyl]amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-benzyl-2-[butan-2-yl(cyclohexylcarbamoyl)amino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: N-benzyl-2-[cyclohexylcarbamoyl(sec-butyl)amino]-N-(2-thenyl)acetamide Formula: C25H35N3O2S MolecularWeight: 441.6293

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CS2)C(=O)NC3CCCCC3

Isomeric SMILES

CCC(C)N(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CS2)C(=O)NC3CCCCC3

InChI

InChI=1S/C25H35N3O2S/c1-3-20(2)28(25(30)26-22-13-8-5-9-14-22)19-24(29)27(18-23-15-10-16-31-23)17-21-11-6-4-7-12-21/h4,6-7,10-12,15-16,20,22H,3,5,8-9,13-14,17-19H2,1-2H3,(H,26,30)