tert-butyl N-[(3-azanyl-2-methyl-2H-1,4-benzoxazin-6-yl)methyl]-N-[butyl(phenylcarbamoyl)amino]carbamate

Systemtic Name: tert-butyl N-[(3-azanyl-2-methyl-2H-1,4-benzoxazin-6-yl)methyl]-N-[butyl(phenylcarbamoyl)amino]carbamate Openeye Name: tert-butyl N-[(3-amino-2-methyl-2H-1,4-benzoxazin-6-yl)methyl]-N-[butyl(phenylcarbamoyl)amino]carbamate CAS Name: N-[(3-amino-2-methyl-2H-1,4-benzoxazin-6-yl)methyl]-N-[[anilino(oxo)methyl]-butylamino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3-amino-2-methyl-2H-1,4-benzoxazin-6-yl)methyl]-N-[butyl(phenylcarbamoyl)amino]carbamate Traditional Name: N-[(3-amino-2-methyl-2H-1,4-benzoxazin-6-yl)methyl]-N-[butyl(phenylcarbamoyl)amino]carbamic acid tert-butyl ester Formula: C26H35N5O4 MolecularWeight: 481.5872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(=O)NC1=CC=CC=C1)N(CC2=CC3=C(C=C2)OC(C(=N3)N)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCN(C(=O)NC1=CC=CC=C1)N(CC2=CC3=C(C=C2)OC(C(=N3)N)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C26H35N5O4/c1-6-7-15-30(24(32)28-20-11-9-8-10-12-20)31(25(33)35-26(3,4)5)17-19-13-14-22-21(16-19)29-23(27)18(2)34-22/h8-14,16,18H,6-7,15,17H2,1-5H3,(H2,27,29)(H,28,32)