tert-butyl 3-[azanyl-[(4-methoxyphenyl)methyl]amino]-2-(cyclohexylmethylsulfonylmethyl)-3-oxidanylidene-propanoate

Systemtic Name: tert-butyl 3-[azanyl-[(4-methoxyphenyl)methyl]amino]-2-(cyclohexylmethylsulfonylmethyl)-3-oxidanylidene-propanoate Openeye Name: tert-butyl 3-[amino-[(4-methoxyphenyl)methyl]amino]-2-(cyclohexylmethylsulfonylmethyl)-3-oxo-propanoate CAS Name: 3-[amino-[(4-methoxyphenyl)methyl]amino]-2-(cyclohexylmethylsulfonylmethyl)-3-oxopropanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[amino-[(4-methoxyphenyl)methyl]amino]-2-(cyclohexylmethylsulfonylmethyl)-3-oxopropanoate Traditional Name: 3-[amino(p-anisyl)amino]-2-(cyclohexylmethylsulfonylmethyl)-3-keto-propionic acid tert-butyl ester Formula: C23H36N2O6S MolecularWeight: 468.60674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CS(=O)(=O)CC1CCCCC1)C(=O)N(CC2=CC=C(C=C2)OC)N

Isomeric SMILES

CC(C)(C)OC(=O)C(CS(=O)(=O)CC1CCCCC1)C(=O)N(CC2=CC=C(C=C2)OC)N

InChI

InChI=1S/C23H36N2O6S/c1-23(2,3)31-22(27)20(16-32(28,29)15-18-8-6-5-7-9-18)21(26)25(24)14-17-10-12-19(30-4)13-11-17/h10-13,18,20H,5-9,14-16,24H2,1-4H3