6-[[4-oxidanylidene-2-(thiophen-2-ylmethyl)-3,1-benzoxazin-6-yl]methyl]-2-(thiophen-2-ylmethyl)-3,1-benzoxazin-4-one

Systemtic Name: 6-[[4-oxidanylidene-2-(thiophen-2-ylmethyl)-3,1-benzoxazin-6-yl]methyl]-2-(thiophen-2-ylmethyl)-3,1-benzoxazin-4-one Openeye Name: 6-[[4-oxo-2-(2-thienylmethyl)-3,1-benzoxazin-6-yl]methyl]-2-(2-thienylmethyl)-3,1-benzoxazin-4-one CAS Name: 6-[[4-oxo-2-(thiophen-2-ylmethyl)-3,1-benzoxazin-6-yl]methyl]-2-(thiophen-2-ylmethyl)-3,1-benzoxazin-4-one IUPAC Name: 6-[[4-oxo-2-(thiophen-2-ylmethyl)-3,1-benzoxazin-6-yl]methyl]-2-(thiophen-2-ylmethyl)-3,1-benzoxazin-4-one Traditional Name: 6-[[4-keto-2-(2-thenyl)-3,1-benzoxazin-6-yl]methyl]-2-(2-thenyl)-3,1-benzoxazin-4-one Formula: C27H18N2O4S2 MolecularWeight: 498.57282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CC2=NC3=C(C=C(C=C3)CC4=CC5=C(C=C4)N=C(OC5=O)CC6=CC=CS6)C(=O)O2

Isomeric SMILES

C1=CSC(=C1)CC2=NC3=C(C=C(C=C3)CC4=CC5=C(C=C4)N=C(OC5=O)CC6=CC=CS6)C(=O)O2

InChI

InChI=1S/C27H18N2O4S2/c30-26-20-12-16(5-7-22(20)28-24(32-26)14-18-3-1-9-34-18)11-17-6-8-23-21(13-17)27(31)33-25(29-23)15-19-4-2-10-35-19/h1-10,12-13H,11,14-15H2