[2-(pyridin-2-ylcarbamoylamino)phenyl] 2-[(2-azanyl-4-methyl-pentanoyl)-ethanoyl-amino]-3-(4-methoxyphenyl)propanoate

Systemtic Name: [2-(pyridin-2-ylcarbamoylamino)phenyl] 2-[(2-azanyl-4-methyl-pentanoyl)-ethanoyl-amino]-3-(4-methoxyphenyl)propanoate Openeye Name: [2-(2-pyridylcarbamoylamino)phenyl] 2-[acetyl-(2-amino-4-methyl-pentanoyl)amino]-3-(4-methoxyphenyl)propanoate CAS Name: 2-[acetyl-(2-amino-4-methyl-1-oxopentyl)amino]-3-(4-methoxyphenyl)propanoic acid [2-[[oxo-(2-pyridinylamino)methyl]amino]phenyl] ester IUPAC Name: [2-(pyridin-2-ylcarbamoylamino)phenyl] 2-[acetyl-(2-amino-4-methylpentanoyl)amino]-3-(4-methoxyphenyl)propanoate Traditional Name: 2-[acetyl-(2-amino-4-methyl-pentanoyl)amino]-3-(4-methoxyphenyl)propionic acid [2-(2-pyridylcarbamoylamino)phenyl] ester Formula: C30H35N5O6 MolecularWeight: 561.6288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N(C(CC1=CC=C(C=C1)OC)C(=O)OC2=CC=CC=C2NC(=O)NC3=CC=CC=N3)C(=O)C)N

Isomeric SMILES

CC(C)CC(C(=O)N(C(CC1=CC=C(C=C1)OC)C(=O)OC2=CC=CC=C2NC(=O)NC3=CC=CC=N3)C(=O)C)N

InChI

InChI=1S/C30H35N5O6/c1-19(2)17-23(31)28(37)35(20(3)36)25(18-21-12-14-22(40-4)15-13-21)29(38)41-26-10-6-5-9-24(26)33-30(39)34-27-11-7-8-16-32-27/h5-16,19,23,25H,17-18,31H2,1-4H3,(H2,32,33,34,39)