6-[3-(anthracen-9-ylmethylideneamino)-2-methylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[3-(anthracen-9-ylmethylideneamino)-2-methylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-(9-anthrylmethyleneamino)-2-methylimino-thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-(9-anthracenylmethylideneamino)-2-methylimino-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-(anthracen-9-ylmethylideneamino)-2-methylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-(9-anthrylmethyleneamino)-2-methylimino-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C27H20N4O2S MolecularWeight: 464.5383

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Descriptors Computed from Structure

Canonical SMILES:

CN=C1N(C(=CS1)C2=CC3=C(C=C2)OCC(=O)N3)N=CC4=C5C=CC=CC5=CC6=CC=CC=C64

Isomeric SMILES

CN=C1N(C(=CS1)C2=CC3=C(C=C2)OCC(=O)N3)N=CC4=C5C=CC=CC5=CC6=CC=CC=C64

InChI

InChI=1S/C27H20N4O2S/c1-28-27-31(24(16-34-27)19-10-11-25-23(13-19)30-26(32)15-33-25)29-14-22-20-8-4-2-6-17(20)12-18-7-3-5-9-21(18)22/h2-14,16H,15H2,1H3,(H,30,32)