N-[2-[(4-butylphenyl)carbonylamino]cyclohexyl]-2-(phenoxymethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: N-[2-[(4-butylphenyl)carbonylamino]cyclohexyl]-2-(phenoxymethyl)-1,3-thiazole-4-carboxamide Openeye Name: N-[2-[(4-butylbenzoyl)amino]cyclohexyl]-2-(phenoxymethyl)thiazole-4-carboxamide CAS Name: N-[2-[[(4-butylphenyl)-oxomethyl]amino]cyclohexyl]-2-(phenoxymethyl)-4-thiazolecarboxamide IUPAC Name: N-[2-[(4-butylbenzoyl)amino]cyclohexyl]-2-(phenoxymethyl)-1,3-thiazole-4-carboxamide Traditional Name: N-[2-[(4-butylbenzoyl)amino]cyclohexyl]-2-(phenoxymethyl)thiazole-4-carboxamide Formula: C28H33N3O3S MolecularWeight: 491.64492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)NC2CCCCC2NC(=O)C3=CSC(=N3)COC4=CC=CC=C4

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)NC2CCCCC2NC(=O)C3=CSC(=N3)COC4=CC=CC=C4

InChI

InChI=1S/C28H33N3O3S/c1-2-3-9-20-14-16-21(17-15-20)27(32)30-23-12-7-8-13-24(23)31-28(33)25-19-35-26(29-25)18-34-22-10-5-4-6-11-22/h4-6,10-11,14-17,19,23-24H,2-3,7-9,12-13,18H2,1H3,(H,30,32)(H,31,33)