[4-[[2-aminocarbonyl-5-(3,4,5-trimethoxyphenyl)sulfanyl-phenyl]amino]cyclohexyl] 2-azanylethanoate

Systemtic Name: [4-[[2-aminocarbonyl-5-(3,4,5-trimethoxyphenyl)sulfanyl-phenyl]amino]cyclohexyl] 2-azanylethanoate Openeye Name: [4-[2-carbamoyl-5-(3,4,5-trimethoxyphenyl)sulfanyl-anilino]cyclohexyl] 2-aminoacetate CAS Name: 2-aminoacetic acid [4-[2-carbamoyl-5-[(3,4,5-trimethoxyphenyl)thio]anilino]cyclohexyl] ester IUPAC Name: [4-[2-carbamoyl-5-(3,4,5-trimethoxyphenyl)sulfanylanilino]cyclohexyl] 2-aminoacetate Traditional Name: 2-aminoacetic acid [4-[2-carbamoyl-5-[(3,4,5-trimethoxyphenyl)thio]anilino]cyclohexyl] ester Formula: C24H31N3O6S MolecularWeight: 489.58444

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)SC2=CC(=C(C=C2)C(=O)N)NC3CCC(CC3)OC(=O)CN

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)SC2=CC(=C(C=C2)C(=O)N)NC3CCC(CC3)OC(=O)CN

InChI

InChI=1S/C24H31N3O6S/c1-30-20-11-17(12-21(31-2)23(20)32-3)34-16-8-9-18(24(26)29)19(10-16)27-14-4-6-15(7-5-14)33-22(28)13-25/h8-12,14-15,27H,4-7,13,25H2,1-3H3,(H2,26,29)