N-[(2S)-3-[cyclopentylmethyl-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]amino]-2-oxidanyl-propyl]-N-phenethyl-benzamide

Systemtic Name: N-[(2S)-3-[cyclopentylmethyl-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]amino]-2-oxidanyl-propyl]-N-phenethyl-benzamide Openeye Name: N-[(2S)-3-[cyclopentylmethyl-[(5-methylisoxazol-3-yl)methylsulfonyl]amino]-2-hydroxy-propyl]-N-phenethyl-benzamide CAS Name: N-[(2S)-3-[cyclopentylmethyl-[(5-methyl-3-isoxazolyl)methylsulfonyl]amino]-2-hydroxypropyl]-N-phenethylbenzamide IUPAC Name: N-[(2S)-3-[cyclopentylmethyl-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]amino]-2-hydroxypropyl]-N-phenethylbenzamide Traditional Name: N-[(2S)-3-[cyclopentylmethyl-[(5-methylisoxazol-3-yl)methylsulfonyl]amino]-2-hydroxy-propyl]-N-phenethyl-benzamide Formula: C29H37N3O5S MolecularWeight: 539.68618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CS(=O)(=O)N(CC2CCCC2)CC(CN(CCC3=CC=CC=C3)C(=O)C4=CC=CC=C4)O

Isomeric SMILES

CC1=CC(=NO1)CS(=O)(=O)N(CC2CCCC2)C[C@H](CN(CCC3=CC=CC=C3)C(=O)C4=CC=CC=C4)O

InChI

InChI=1S/C29H37N3O5S/c1-23-18-27(30-37-23)22-38(35,36)32(19-25-12-8-9-13-25)21-28(33)20-31(17-16-24-10-4-2-5-11-24)29(34)26-14-6-3-7-15-26/h2-7,10-11,14-15,18,25,28,33H,8-9,12-13,16-17,19-22H2,1H3/t28-/m0/s1