2-ethyl-4-[(2-phenylimino-1,3-thiazinan-3-yl)carbonyl]phthalazin-1-one

Systemtic Name: 2-ethyl-4-[(2-phenylimino-1,3-thiazinan-3-yl)carbonyl]phthalazin-1-one Openeye Name: 2-ethyl-4-(2-phenylimino-1,3-thiazinane-3-carbonyl)phthalazin-1-one CAS Name: 2-ethyl-4-[oxo-(2-phenylimino-1,3-thiazinan-3-yl)methyl]-1-phthalazinone IUPAC Name: 2-ethyl-4-(2-phenylimino-1,3-thiazinane-3-carbonyl)phthalazin-1-one Traditional Name: 2-ethyl-4-(2-phenylimino-1,3-thiazinane-3-carbonyl)phthalazin-1-one Formula: C21H20N4O2S MolecularWeight: 392.4741

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCCSC3=NC4=CC=CC=C4

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCCSC3=NC4=CC=CC=C4

InChI

InChI=1S/C21H20N4O2S/c1-2-25-19(26)17-12-7-6-11-16(17)18(23-25)20(27)24-13-8-14-28-21(24)22-15-9-4-3-5-10-15/h3-7,9-12H,2,8,13-14H2,1H3