ethyl 2-[2-[2-(5-azanyl-6-oxidanylidene-2-pyridin-3-yl-pyrimidin-1-yl)ethanoylamino]-3-phenyl-propanoyl]-1,3-benzoxazole-5-carboxylate

Systemtic Name: ethyl 2-[2-[2-(5-azanyl-6-oxidanylidene-2-pyridin-3-yl-pyrimidin-1-yl)ethanoylamino]-3-phenyl-propanoyl]-1,3-benzoxazole-5-carboxylate Openeye Name: ethyl 2-[2-[[2-[5-amino-6-oxo-2-(3-pyridyl)pyrimidin-1-yl]acetyl]amino]-3-phenyl-propanoyl]-1,3-benzoxazole-5-carboxylate CAS Name: 2-[2-[[2-[5-amino-6-oxo-2-(3-pyridinyl)-1-pyrimidinyl]-1-oxoethyl]amino]-1-oxo-3-phenylpropyl]-1,3-benzoxazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-[[2-(5-amino-6-oxo-2-pyridin-3-ylpyrimidin-1-yl)acetyl]amino]-3-phenylpropanoyl]-1,3-benzoxazole-5-carboxylate Traditional Name: 2-[2-[[2-[5-amino-6-keto-2-(3-pyridyl)pyrimidin-1-yl]acetyl]amino]-3-phenyl-propanoyl]-1,3-benzoxazole-5-carboxylic acid ethyl ester Formula: C30H26N6O6 MolecularWeight: 566.56404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)OC(=N2)C(=O)C(CC3=CC=CC=C3)NC(=O)CN4C(=NC=C(C4=O)N)C5=CN=CC=C5

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)OC(=N2)C(=O)C(CC3=CC=CC=C3)NC(=O)CN4C(=NC=C(C4=O)N)C5=CN=CC=C5

InChI

InChI=1S/C30H26N6O6/c1-2-41-30(40)19-10-11-24-22(14-19)35-28(42-24)26(38)23(13-18-7-4-3-5-8-18)34-25(37)17-36-27(20-9-6-12-32-15-20)33-16-21(31)29(36)39/h3-12,14-16,23H,2,13,17,31H2,1H3,(H,34,37)