N-[1-[[(2S)-1-(1,3-benzoxazol-2-yl)-1-oxidanylidene-pentan-2-yl]carbamoyl]cyclohexyl]-4-methylsulfonyl-benzamide

Systemtic Name: N-[1-[[(2S)-1-(1,3-benzoxazol-2-yl)-1-oxidanylidene-pentan-2-yl]carbamoyl]cyclohexyl]-4-methylsulfonyl-benzamide Openeye Name: N-[1-[[(1S)-1-(1,3-benzoxazole-2-carbonyl)butyl]carbamoyl]cyclohexyl]-4-methylsulfonyl-benzamide CAS Name: N-[1-[[[(2S)-1-(1,3-benzoxazol-2-yl)-1-oxopentan-2-yl]amino]-oxomethyl]cyclohexyl]-4-methylsulfonylbenzamide IUPAC Name: N-[1-[[(2S)-1-(1,3-benzoxazol-2-yl)-1-oxopentan-2-yl]carbamoyl]cyclohexyl]-4-methylsulfonylbenzamide Traditional Name: N-[1-[[(1S)-1-(1,3-benzoxazole-2-carbonyl)butyl]carbamoyl]cyclohexyl]-4-mesyl-benzamide Formula: C27H31N3O6S MolecularWeight: 525.61654

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)C1=NC2=CC=CC=C2O1)NC(=O)C3(CCCCC3)NC(=O)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CCC[C@@H](C(=O)C1=NC2=CC=CC=C2O1)NC(=O)C3(CCCCC3)NC(=O)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C27H31N3O6S/c1-3-9-21(23(31)25-28-20-10-5-6-11-22(20)36-25)29-26(33)27(16-7-4-8-17-27)30-24(32)18-12-14-19(15-13-18)37(2,34)35/h5-6,10-15,21H,3-4,7-9,16-17H2,1-2H3,(H,29,33)(H,30,32)/t21-/m0/s1