6-[3-[(4-phenylazanylphenyl)methylideneamino]-2-prop-2-enylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[3-[(4-phenylazanylphenyl)methylideneamino]-2-prop-2-enylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-allylimino-3-[(4-anilinophenyl)methyleneamino]thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-[(4-anilinophenyl)methylideneamino]-2-prop-2-enylimino-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-[(4-anilinophenyl)methylideneamino]-2-prop-2-enylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-allylimino-3-[(4-anilinobenzylidene)amino]-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C27H23N5O2S MolecularWeight: 481.56882

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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=CC=C(C=C4)NC5=CC=CC=C5

Isomeric SMILES

C=CCN=C1N(C(=CS1)C2=CC3=C(C=C2)OCC(=O)N3)N=CC4=CC=C(C=C4)NC5=CC=CC=C5

InChI

InChI=1S/C27H23N5O2S/c1-2-14-28-27-32(24(18-35-27)20-10-13-25-23(15-20)31-26(33)17-34-25)29-16-19-8-11-22(12-9-19)30-21-6-4-3-5-7-21/h2-13,15-16,18,30H,1,14,17H2,(H,31,33)