6-chloranyl-3-(4-methoxyphenyl)-4-(2-oxidanylidene-2-thiophen-2-yl-ethyl)-4H-1,3-benzoxazin-2-one

Systemtic Name: 6-chloranyl-3-(4-methoxyphenyl)-4-(2-oxidanylidene-2-thiophen-2-yl-ethyl)-4H-1,3-benzoxazin-2-one Openeye Name: 6-chloro-3-(4-methoxyphenyl)-4-[2-oxo-2-(2-thienyl)ethyl]-4H-1,3-benzoxazin-2-one CAS Name: 6-chloro-3-(4-methoxyphenyl)-4-(2-oxo-2-thiophen-2-ylethyl)-4H-1,3-benzoxazin-2-one IUPAC Name: 6-chloro-3-(4-methoxyphenyl)-4-(2-oxo-2-thiophen-2-ylethyl)-4H-1,3-benzoxazin-2-one Traditional Name: 6-chloro-4-[2-keto-2-(2-thienyl)ethyl]-3-(4-methoxyphenyl)-4H-1,3-benzoxazin-2-one Formula: C21H16ClNO4S MolecularWeight: 413.87404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(C3=C(C=CC(=C3)Cl)OC2=O)CC(=O)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(C3=C(C=CC(=C3)Cl)OC2=O)CC(=O)C4=CC=CS4

InChI

InChI=1S/C21H16ClNO4S/c1-26-15-7-5-14(6-8-15)23-17(12-18(24)20-3-2-10-28-20)16-11-13(22)4-9-19(16)27-21(23)25/h2-11,17H,12H2,1H3