N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-(1-cyclopropylimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-(1-cyclopropylimidazol-2-yl)sulfanyl-propanamide Openeye Name: 2-(1-cyclopropylimidazol-2-yl)sulfanyl-N-(9,10-dioxo-2-anthryl)propanamide CAS Name: 2-[(1-cyclopropyl-2-imidazolyl)thio]-N-(9,10-dioxo-2-anthracenyl)propanamide IUPAC Name: 2-(1-cyclopropylimidazol-2-yl)sulfanyl-N-(9,10-dioxoanthracen-2-yl)propanamide Traditional Name: 2-[(1-cyclopropylimidazol-2-yl)thio]-N-(9,10-diketo-2-anthryl)propionamide Formula: C23H19N3O3S MolecularWeight: 417.48026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)SC4=NC=CN4C5CC5

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)SC4=NC=CN4C5CC5

InChI

InChI=1S/C23H19N3O3S/c1-13(30-23-24-10-11-26(23)15-7-8-15)22(29)25-14-6-9-18-19(12-14)21(28)17-5-3-2-4-16(17)20(18)27/h2-6,9-13,15H,7-8H2,1H3,(H,25,29)