2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-[9,10-bis(oxidanylidene)anthracen-2-yl]ethanamide

Systemtic Name: 2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-[9,10-bis(oxidanylidene)anthracen-2-yl]ethanamide Openeye Name: 2-(1-amino-4-phenyl-imidazol-2-yl)sulfanyl-N-(9,10-dioxo-2-anthryl)acetamide CAS Name: 2-[(1-amino-4-phenyl-2-imidazolyl)thio]-N-(9,10-dioxo-2-anthracenyl)acetamide IUPAC Name: 2-(1-amino-4-phenylimidazol-2-yl)sulfanyl-N-(9,10-dioxoanthracen-2-yl)acetamide Traditional Name: 2-[(1-amino-4-phenyl-imidazol-2-yl)thio]-N-(9,10-diketo-2-anthryl)acetamide Formula: C25H18N4O3S MolecularWeight: 454.50042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(C(=N2)SCC(=O)NC3=CC4=C(C=C3)C(=O)C5=CC=CC=C5C4=O)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(C(=N2)SCC(=O)NC3=CC4=C(C=C3)C(=O)C5=CC=CC=C5C4=O)N

InChI

InChI=1S/C25H18N4O3S/c26-29-13-21(15-6-2-1-3-7-15)28-25(29)33-14-22(30)27-16-10-11-19-20(12-16)24(32)18-9-5-4-8-17(18)23(19)31/h1-13H,14,26H2,(H,27,30)