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

Systemtic Name: 6-[3-(anthracen-9-ylmethylideneamino)-2-prop-2-enylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-allylimino-3-(9-anthrylmethyleneamino)thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-(9-anthracenylmethylideneamino)-2-prop-2-enylimino-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-(anthracen-9-ylmethylideneamino)-2-prop-2-enylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-allylimino-3-(9-anthrylmethyleneamino)-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C29H22N4O2S MolecularWeight: 490.57558

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H22N4O2S/c1-2-13-30-29-33(26(18-36-29)21-11-12-27-25(15-21)32-28(34)17-35-27)31-16-24-22-9-5-3-7-19(22)14-20-8-4-6-10-23(20)24/h2-12,14-16,18H,1,13,17H2,(H,32,34)