tert-butyl N-[5-methyl-4-oxidanylidene-2-[3-phenylpropyl(pyridin-2-ylmethylcarbamoyl)amino]-3,1-benzoxazin-6-yl]carbamate

Systemtic Name: tert-butyl N-[5-methyl-4-oxidanylidene-2-[3-phenylpropyl(pyridin-2-ylmethylcarbamoyl)amino]-3,1-benzoxazin-6-yl]carbamate Openeye Name: tert-butyl N-[5-methyl-4-oxo-2-[3-phenylpropyl(2-pyridylmethylcarbamoyl)amino]-3,1-benzoxazin-6-yl]carbamate CAS Name: N-[5-methyl-4-oxo-2-[[oxo-(2-pyridinylmethylamino)methyl]-(3-phenylpropyl)amino]-3,1-benzoxazin-6-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-methyl-4-oxo-2-[3-phenylpropyl(pyridin-2-ylmethylcarbamoyl)amino]-3,1-benzoxazin-6-yl]carbamate Traditional Name: N-[4-keto-5-methyl-2-[3-phenylpropyl(2-pyridylmethylcarbamoyl)amino]-3,1-benzoxazin-6-yl]carbamic acid tert-butyl ester Formula: C30H33N5O5 MolecularWeight: 543.61352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=O)OC(=N2)N(CCCC3=CC=CC=C3)C(=O)NCC4=CC=CC=N4)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC2=C1C(=O)OC(=N2)N(CCCC3=CC=CC=C3)C(=O)NCC4=CC=CC=N4)NC(=O)OC(C)(C)C

InChI

InChI=1S/C30H33N5O5/c1-20-23(34-29(38)40-30(2,3)4)15-16-24-25(20)26(36)39-28(33-24)35(18-10-13-21-11-6-5-7-12-21)27(37)32-19-22-14-8-9-17-31-22/h5-9,11-12,14-17H,10,13,18-19H2,1-4H3,(H,32,37)(H,34,38)