N-[2-[[3-(4-methoxyphenyl)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]amino]-5-methyl-4-oxidanylidene-3,1-benzoxazin-6-yl]-2-thiophen-2-yl-ethanamide

Systemtic Name: N-[2-[[3-(4-methoxyphenyl)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]amino]-5-methyl-4-oxidanylidene-3,1-benzoxazin-6-yl]-2-thiophen-2-yl-ethanamide Openeye Name: N-[2-[[1-[(4-methoxyphenyl)methyl]-2-oxo-2-pyrrolidin-1-yl-ethyl]amino]-5-methyl-4-oxo-3,1-benzoxazin-6-yl]-2-(2-thienyl)acetamide CAS Name: N-[2-[[3-(4-methoxyphenyl)-1-oxo-1-(1-pyrrolidinyl)propan-2-yl]amino]-5-methyl-4-oxo-3,1-benzoxazin-6-yl]-2-thiophen-2-ylacetamide IUPAC Name: N-[2-[[3-(4-methoxyphenyl)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]amino]-5-methyl-4-oxo-3,1-benzoxazin-6-yl]-2-thiophen-2-ylacetamide Traditional Name: N-[4-keto-2-[(2-keto-1-p-anisyl-2-pyrrolidino-ethyl)amino]-5-methyl-3,1-benzoxazin-6-yl]-2-(2-thienyl)acetamide Formula: C29H30N4O5S MolecularWeight: 546.6373

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=O)OC(=N2)NC(CC3=CC=C(C=C3)OC)C(=O)N4CCCC4)NC(=O)CC5=CC=CS5

Isomeric SMILES

CC1=C(C=CC2=C1C(=O)OC(=N2)NC(CC3=CC=C(C=C3)OC)C(=O)N4CCCC4)NC(=O)CC5=CC=CS5

InChI

InChI=1S/C29H30N4O5S/c1-18-22(30-25(34)17-21-6-5-15-39-21)11-12-23-26(18)28(36)38-29(31-23)32-24(27(35)33-13-3-4-14-33)16-19-7-9-20(37-2)10-8-19/h5-12,15,24H,3-4,13-14,16-17H2,1-2H3,(H,30,34)(H,31,32)