(3-azanylpyridin-4-yl)methyl N-ethyl-N-[4-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]carbamate

Systemtic Name: (3-azanylpyridin-4-yl)methyl N-ethyl-N-[4-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]carbamate Openeye Name: (3-amino-4-pyridyl)methyl N-ethyl-N-[4-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]carbamate CAS Name: N-ethyl-N-[4-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]carbamic acid (3-amino-4-pyridinyl)methyl ester IUPAC Name: (3-aminopyridin-4-yl)methyl N-ethyl-N-[4-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]carbamate Traditional Name: N-ethyl-N-[4-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]carbamic acid (3-amino-4-pyridyl)methyl ester Formula: C21H24N6O3 MolecularWeight: 408.45366

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC2=C(C=C1)OCCN2CC3=CN=CN3)C(=O)OCC4=C(C=NC=C4)N

Isomeric SMILES

CCN(C1=CC2=C(C=C1)OCCN2CC3=CN=CN3)C(=O)OCC4=C(C=NC=C4)N

InChI

InChI=1S/C21H24N6O3/c1-2-27(21(28)30-13-15-5-6-23-11-18(15)22)17-3-4-20-19(9-17)26(7-8-29-20)12-16-10-24-14-25-16/h3-6,9-11,14H,2,7-8,12-13,22H2,1H3,(H,24,25)