7-azanylidene-6-[2-(8-tert-butyl-4-methyl-2,3-dihydro-1,4-benzoxazin-6-yl)-2-oxidanylidene-ethyl]-3-ethoxy-N-methyl-5H-pyrrolo[3,4-b]pyridine-2-carboxamide

Systemtic Name: 7-azanylidene-6-[2-(8-tert-butyl-4-methyl-2,3-dihydro-1,4-benzoxazin-6-yl)-2-oxidanylidene-ethyl]-3-ethoxy-N-methyl-5H-pyrrolo[3,4-b]pyridine-2-carboxamide Openeye Name: 6-[2-(8-tert-butyl-4-methyl-2,3-dihydro-1,4-benzoxazin-6-yl)-2-oxo-ethyl]-3-ethoxy-7-imino-N-methyl-5H-pyrrolo[3,4-b]pyridine-2-carboxamide CAS Name: 6-[2-(8-tert-butyl-4-methyl-2,3-dihydro-1,4-benzoxazin-6-yl)-2-oxoethyl]-3-ethoxy-7-imino-N-methyl-5H-pyrrolo[3,4-b]pyridine-2-carboxamide IUPAC Name: 6-[2-(8-tert-butyl-4-methyl-2,3-dihydro-1,4-benzoxazin-6-yl)-2-oxoethyl]-3-ethoxy-7-imino-N-methyl-5H-pyrrolo[3,4-b]pyridine-2-carboxamide Traditional Name: 6-[2-(8-tert-butyl-4-methyl-2,3-dihydro-1,4-benzoxazin-6-yl)-2-keto-ethyl]-3-ethoxy-7-imino-N-methyl-5H-pyrrolo[3,4-b]pyridine-2-carboxamide Formula: C26H33N5O4 MolecularWeight: 479.57132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(N=C2C(=C1)CN(C2=N)CC(=O)C3=CC(=C4C(=C3)N(CCO4)C)C(C)(C)C)C(=O)NC

Isomeric SMILES

CCOC1=C(N=C2C(=C1)CN(C2=N)CC(=O)C3=CC(=C4C(=C3)N(CCO4)C)C(C)(C)C)C(=O)NC

InChI

InChI=1S/C26H33N5O4/c1-7-34-20-12-16-13-31(24(27)21(16)29-22(20)25(33)28-5)14-19(32)15-10-17(26(2,3)4)23-18(11-15)30(6)8-9-35-23/h10-12,27H,7-9,13-14H2,1-6H3,(H,28,33)