(E)-5-azanyl-N,5-dimethyl-N-[1-[4-methylsulfonyl-2-(phenylmethyl)piperazin-1-yl]-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]hex-2-enamide

Systemtic Name: (E)-5-azanyl-N,5-dimethyl-N-[1-[4-methylsulfonyl-2-(phenylmethyl)piperazin-1-yl]-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]hex-2-enamide Openeye Name: (E)-5-amino-N-[2-(2-benzyl-4-methylsulfonyl-piperazin-1-yl)-1-(benzyloxymethyl)-2-oxo-ethyl]-N,5-dimethyl-hex-2-enamide CAS Name: (E)-5-amino-N,5-dimethyl-N-[1-[4-methylsulfonyl-2-(phenylmethyl)-1-piperazinyl]-1-oxo-3-phenylmethoxypropan-2-yl]-2-hexenamide IUPAC Name: (E)-5-amino-N-[1-(2-benzyl-4-methylsulfonylpiperazin-1-yl)-1-oxo-3-phenylmethoxypropan-2-yl]-N,5-dimethylhex-2-enamide Traditional Name: (E)-5-amino-N-[1-(benzoxymethyl)-2-(2-benzyl-4-mesyl-piperazino)-2-keto-ethyl]-N,5-dimethyl-hex-2-enamide Formula: C30H42N4O5S MolecularWeight: 570.74328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC=CC(=O)N(C)C(COCC1=CC=CC=C1)C(=O)N2CCN(CC2CC3=CC=CC=C3)S(=O)(=O)C)N

Isomeric SMILES

CC(C)(C/C=C/C(=O)N(C)C(COCC1=CC=CC=C1)C(=O)N2CCN(CC2CC3=CC=CC=C3)S(=O)(=O)C)N

InChI

InChI=1S/C30H42N4O5S/c1-30(2,31)17-11-16-28(35)32(3)27(23-39-22-25-14-9-6-10-15-25)29(36)34-19-18-33(40(4,37)38)21-26(34)20-24-12-7-5-8-13-24/h5-16,26-27H,17-23,31H2,1-4H3/b16-11+