ethyl (2S)-2-[(4-aminophenyl)carbonyl-[4-[(2-methylimidazo[4,5-c]pyridin-1-yl)methyl]phenyl]sulfonyl-amino]-4-methyl-pentanoate

Systemtic Name: ethyl (2S)-2-[(4-aminophenyl)carbonyl-[4-[(2-methylimidazo[4,5-c]pyridin-1-yl)methyl]phenyl]sulfonyl-amino]-4-methyl-pentanoate Openeye Name: ethyl (2S)-2-[(4-aminobenzoyl)-[4-[(2-methylimidazo[4,5-c]pyridin-1-yl)methyl]phenyl]sulfonyl-amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[(4-aminophenyl)-oxomethyl]-[4-[(2-methyl-1-imidazo[4,5-c]pyridinyl)methyl]phenyl]sulfonylamino]-4-methylpentanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[(4-aminobenzoyl)-[4-[(2-methylimidazo[4,5-c]pyridin-1-yl)methyl]phenyl]sulfonylamino]-4-methylpentanoate Traditional Name: (2S)-2-[(4-aminobenzoyl)-[4-[(2-methylimidazo[4,5-c]pyridin-1-yl)methyl]phenyl]sulfonyl-amino]-4-methyl-valeric acid ethyl ester Formula: C29H33N5O5S MolecularWeight: 563.66782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)C)N(C(=O)C1=CC=C(C=C1)N)S(=O)(=O)C2=CC=C(C=C2)CN3C(=NC4=C3C=CN=C4)C

Isomeric SMILES

CCOC(=O)[C@H](CC(C)C)N(C(=O)C1=CC=C(C=C1)N)S(=O)(=O)C2=CC=C(C=C2)CN3C(=NC4=C3C=CN=C4)C

InChI

InChI=1S/C29H33N5O5S/c1-5-39-29(36)27(16-19(2)3)34(28(35)22-8-10-23(30)11-9-22)40(37,38)24-12-6-21(7-13-24)18-33-20(4)32-25-17-31-15-14-26(25)33/h6-15,17,19,27H,5,16,18,30H2,1-4H3/t27-/m0/s1