[4-cyano-5-[methyl(2-methylpropyl)amino]-2-[[3-[3-(3-methyl-1,2-oxazol-5-yl)phenyl]-3-oxidanylidene-propanoyl]amino]phenyl]carbamic acid

Systemtic Name: [4-cyano-5-[methyl(2-methylpropyl)amino]-2-[[3-[3-(3-methyl-1,2-oxazol-5-yl)phenyl]-3-oxidanylidene-propanoyl]amino]phenyl]carbamic acid Openeye Name: [4-cyano-5-[isobutyl(methyl)amino]-2-[[3-[3-(3-methylisoxazol-5-yl)phenyl]-3-oxo-propanoyl]amino]phenyl]carbamic acid CAS Name: [4-cyano-2-[[3-[3-(3-methyl-5-isoxazolyl)phenyl]-1,3-dioxopropyl]amino]-5-[methyl(2-methylpropyl)amino]phenyl]carbamic acid IUPAC Name: [4-cyano-5-[methyl(2-methylpropyl)amino]-2-[[3-[3-(3-methyl-1,2-oxazol-5-yl)phenyl]-3-oxopropanoyl]amino]phenyl]carbamic acid Traditional Name: [4-cyano-5-[isobutyl(methyl)amino]-2-[[3-keto-3-[3-(3-methylisoxazol-5-yl)phenyl]propanoyl]amino]phenyl]carbamic acid Formula: C26H27N5O5 MolecularWeight: 489.52308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C2=CC(=CC=C2)C(=O)CC(=O)NC3=C(C=C(C(=C3)C#N)N(C)CC(C)C)NC(=O)O

Isomeric SMILES

CC1=NOC(=C1)C2=CC(=CC=C2)C(=O)CC(=O)NC3=C(C=C(C(=C3)C#N)N(C)CC(C)C)NC(=O)O

InChI

InChI=1S/C26H27N5O5/c1-15(2)14-31(4)22-11-21(29-26(34)35)20(10-19(22)13-27)28-25(33)12-23(32)17-6-5-7-18(9-17)24-8-16(3)30-36-24/h5-11,15,29H,12,14H2,1-4H3,(H,28,33)(H,34,35)