(2S)-2-azanyl-N-[(2S,3S)-2-azanyl-3-methyl-pentanoyl]-2-(3,6-dihydro-2H-pyridin-1-ylcarbonyl)-N-[(2R)-1-(4-methoxyphenyl)-3-oxidanylidene-propan-2-yl]-4-methyl-pentanamide

Systemtic Name: (2S)-2-azanyl-N-[(2S,3S)-2-azanyl-3-methyl-pentanoyl]-2-(3,6-dihydro-2H-pyridin-1-ylcarbonyl)-N-[(2R)-1-(4-methoxyphenyl)-3-oxidanylidene-propan-2-yl]-4-methyl-pentanamide Openeye Name: (2S)-2-amino-N-[(2S,3S)-2-amino-3-methyl-pentanoyl]-2-(3,6-dihydro-2H-pyridine-1-carbonyl)-N-[(1R)-1-formyl-2-(4-methoxyphenyl)ethyl]-4-methyl-pentanamide CAS Name: (2S)-2-amino-N-[(2S,3S)-2-amino-3-methyl-1-oxopentyl]-2-[3,6-dihydro-2H-pyridin-1-yl(oxo)methyl]-N-[(2R)-1-(4-methoxyphenyl)-3-oxopropan-2-yl]-4-methylpentanamide IUPAC Name: (2S)-2-amino-N-[(2S,3S)-2-amino-3-methylpentanoyl]-2-(3,6-dihydro-2H-pyridine-1-carbonyl)-N-[(2R)-1-(4-methoxyphenyl)-3-oxopropan-2-yl]-4-methylpentanamide Traditional Name: (2S)-2-amino-N-[(2S,3S)-2-amino-3-methyl-pentanoyl]-2-(3,6-dihydro-2H-pyridine-1-carbonyl)-N-[(1R)-1-formyl-2-(4-methoxyphenyl)ethyl]-4-methyl-valeramide Formula: C28H42N4O5 MolecularWeight: 514.65688

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N(C(CC1=CC=C(C=C1)OC)C=O)C(=O)C(CC(C)C)(C(=O)N2CCC=CC2)N)N

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)N([C@H](CC1=CC=C(C=C1)OC)C=O)C(=O)[C@](CC(C)C)(C(=O)N2CCC=CC2)N)N

InChI

InChI=1S/C28H42N4O5/c1-6-20(4)24(29)25(34)32(22(18-33)16-21-10-12-23(37-5)13-11-21)27(36)28(30,17-19(2)3)26(35)31-14-8-7-9-15-31/h7-8,10-13,18-20,22,24H,6,9,14-17,29-30H2,1-5H3/t20-,22+,24-,28-/m0/s1