(E)-2-cyclohexyl-N-[(4-methoxyphenyl)methoxy]-2-[(4-methylpentanoylamino)-methylsulfonyl-amino]-5-phenyl-pent-4-enamide

Systemtic Name: (E)-2-cyclohexyl-N-[(4-methoxyphenyl)methoxy]-2-[(4-methylpentanoylamino)-methylsulfonyl-amino]-5-phenyl-pent-4-enamide Openeye Name: (E)-2-cyclohexyl-N-[(4-methoxyphenyl)methoxy]-2-[(4-methylpentanoylamino)-methylsulfonyl-amino]-5-phenyl-pent-4-enamide CAS Name: (E)-2-cyclohexyl-N-[(4-methoxyphenyl)methoxy]-2-[[(4-methyl-1-oxopentyl)amino]-methylsulfonylamino]-5-phenyl-4-pentenamide IUPAC Name: (E)-2-cyclohexyl-N-[(4-methoxyphenyl)methoxy]-2-[(4-methylpentanoylamino)-methylsulfonylamino]-5-phenylpent-4-enamide Traditional Name: (E)-2-cyclohexyl-2-[mesyl-(4-methylpentanoylamino)amino]-N-p-anisyloxy-5-phenyl-pent-4-enamide Formula: C32H45N3O6S MolecularWeight: 599.7812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)NN(C(CC=CC1=CC=CC=C1)(C2CCCCC2)C(=O)NOCC3=CC=C(C=C3)OC)S(=O)(=O)C

Isomeric SMILES

CC(C)CCC(=O)NN(C(C/C=C/C1=CC=CC=C1)(C2CCCCC2)C(=O)NOCC3=CC=C(C=C3)OC)S(=O)(=O)C

InChI

InChI=1S/C32H45N3O6S/c1-25(2)17-22-30(36)33-35(42(4,38)39)32(28-15-9-6-10-16-28,23-11-14-26-12-7-5-8-13-26)31(37)34-41-24-27-18-20-29(40-3)21-19-27/h5,7-8,11-14,18-21,25,28H,6,9-10,15-17,22-24H2,1-4H3,(H,33,36)(H,34,37)/b14-11+