methyl 2-azanyl-5-[3-[[5-methyl-1-(4-methylphenyl)sulfonyl-imidazol-4-yl]methylideneamino]-2-phenyl-phenyl]-4-methylsulfanyl-5-oxidanylidene-pentanoate

Systemtic Name: methyl 2-azanyl-5-[3-[[5-methyl-1-(4-methylphenyl)sulfonyl-imidazol-4-yl]methylideneamino]-2-phenyl-phenyl]-4-methylsulfanyl-5-oxidanylidene-pentanoate Openeye Name: methyl 2-amino-5-[3-[[5-methyl-1-(p-tolylsulfonyl)imidazol-4-yl]methyleneamino]-2-phenyl-phenyl]-4-methylsulfanyl-5-oxo-pentanoate CAS Name: 2-amino-5-[3-[[5-methyl-1-(4-methylphenyl)sulfonyl-4-imidazolyl]methylideneamino]-2-phenylphenyl]-4-(methylthio)-5-oxopentanoic acid methyl ester IUPAC Name: methyl 2-amino-5-[3-[[5-methyl-1-(4-methylphenyl)sulfonylimidazol-4-yl]methylideneamino]-2-phenylphenyl]-4-methylsulfanyl-5-oxopentanoate Traditional Name: 2-amino-5-keto-4-(methylthio)-5-[3-[(5-methyl-1-tosyl-imidazol-4-yl)methyleneamino]-2-phenyl-phenyl]valeric acid methyl ester Formula: C31H32N4O5S2 MolecularWeight: 604.73958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=NC(=C2C)C=NC3=CC=CC(=C3C4=CC=CC=C4)C(=O)C(CC(C(=O)OC)N)SC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=NC(=C2C)C=NC3=CC=CC(=C3C4=CC=CC=C4)C(=O)C(CC(C(=O)OC)N)SC

InChI

InChI=1S/C31H32N4O5S2/c1-20-13-15-23(16-14-20)42(38,39)35-19-34-27(21(35)2)18-33-26-12-8-11-24(29(26)22-9-6-5-7-10-22)30(36)28(41-4)17-25(32)31(37)40-3/h5-16,18-19,25,28H,17,32H2,1-4H3