N-[2-[[(2S)-1-(1,3-benzoxazol-2-yl)-1-oxidanylidene-butan-2-yl]amino]-1-cyclohexyl-2-oxidanylidene-ethyl]-2-chloranyl-4-(2-chlorophenyl)benzamide

Systemtic Name: N-[2-[[(2S)-1-(1,3-benzoxazol-2-yl)-1-oxidanylidene-butan-2-yl]amino]-1-cyclohexyl-2-oxidanylidene-ethyl]-2-chloranyl-4-(2-chlorophenyl)benzamide Openeye Name: N-[2-[[(1S)-1-(1,3-benzoxazole-2-carbonyl)propyl]amino]-1-cyclohexyl-2-oxo-ethyl]-2-chloro-4-(2-chlorophenyl)benzamide CAS Name: N-[2-[[(2S)-1-(1,3-benzoxazol-2-yl)-1-oxobutan-2-yl]amino]-1-cyclohexyl-2-oxoethyl]-2-chloro-4-(2-chlorophenyl)benzamide IUPAC Name: N-[2-[[(2S)-1-(1,3-benzoxazol-2-yl)-1-oxobutan-2-yl]amino]-1-cyclohexyl-2-oxoethyl]-2-chloro-4-(2-chlorophenyl)benzamide Traditional Name: N-[2-[[(1S)-1-(1,3-benzoxazole-2-carbonyl)propyl]amino]-1-cyclohexyl-2-keto-ethyl]-2-chloro-4-(2-chlorophenyl)benzamide Formula: C32H31Cl2N3O4 MolecularWeight: 592.51224

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=NC2=CC=CC=C2O1)NC(=O)C(C3CCCCC3)NC(=O)C4=C(C=C(C=C4)C5=CC=CC=C5Cl)Cl

Isomeric SMILES

CC[C@@H](C(=O)C1=NC2=CC=CC=C2O1)NC(=O)C(C3CCCCC3)NC(=O)C4=C(C=C(C=C4)C5=CC=CC=C5Cl)Cl

InChI

InChI=1S/C32H31Cl2N3O4/c1-2-25(29(38)32-36-26-14-8-9-15-27(26)41-32)35-31(40)28(19-10-4-3-5-11-19)37-30(39)22-17-16-20(18-24(22)34)21-12-6-7-13-23(21)33/h6-9,12-19,25,28H,2-5,10-11H2,1H3,(H,35,40)(H,37,39)/t25-,28?/m0/s1