[4-chloranyl-5-(dimethylamino)-2-[[3-[3-[5-(oxan-2-yloxymethyl)-1,2,3-triazol-1-yl]phenyl]-3-oxidanylidene-propanoyl]amino]phenyl]carbamic acid

Systemtic Name: [4-chloranyl-5-(dimethylamino)-2-[[3-[3-[5-(oxan-2-yloxymethyl)-1,2,3-triazol-1-yl]phenyl]-3-oxidanylidene-propanoyl]amino]phenyl]carbamic acid Openeye Name: [4-chloro-5-(dimethylamino)-2-[[3-oxo-3-[3-[5-(tetrahydropyran-2-yloxymethyl)triazol-1-yl]phenyl]propanoyl]amino]phenyl]carbamic acid CAS Name: [4-chloro-5-(dimethylamino)-2-[[3-[3-[5-(2-oxanyloxymethyl)-1-triazolyl]phenyl]-1,3-dioxopropyl]amino]phenyl]carbamic acid IUPAC Name: [4-chloro-5-(dimethylamino)-2-[[3-[3-[5-(oxan-2-yloxymethyl)triazol-1-yl]phenyl]-3-oxopropanoyl]amino]phenyl]carbamic acid Traditional Name: [4-chloro-5-(dimethylamino)-2-[[3-keto-3-[3-[5-(tetrahydropyran-2-yloxymethyl)triazol-1-yl]phenyl]propanoyl]amino]phenyl]carbamic acid Formula: C26H29ClN6O6 MolecularWeight: 556.99806

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C(=C1)NC(=O)O)NC(=O)CC(=O)C2=CC(=CC=C2)N3C(=CN=N3)COC4CCCCO4)Cl

Isomeric SMILES

CN(C)C1=C(C=C(C(=C1)NC(=O)O)NC(=O)CC(=O)C2=CC(=CC=C2)N3C(=CN=N3)COC4CCCCO4)Cl

InChI

InChI=1S/C26H29ClN6O6/c1-32(2)22-12-21(30-26(36)37)20(11-19(22)27)29-24(35)13-23(34)16-6-5-7-17(10-16)33-18(14-28-31-33)15-39-25-8-3-4-9-38-25/h5-7,10-12,14,25,30H,3-4,8-9,13,15H2,1-2H3,(H,29,35)(H,36,37)