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

Systemtic Name: 6-[3-[(3-phenoxyphenyl)methylideneamino]-2-prop-2-enylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-allylimino-3-[(3-phenoxyphenyl)methyleneamino]thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-[(3-phenoxyphenyl)methylideneamino]-2-prop-2-enylimino-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-[(3-phenoxyphenyl)methylideneamino]-2-prop-2-enylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-allylimino-3-[(3-phenoxybenzylidene)amino]-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C27H22N4O3S MolecularWeight: 482.55358

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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(=CC=C4)OC5=CC=CC=C5

Isomeric SMILES

C=CCN=C1N(C(=CS1)C2=CC3=C(C=C2)OCC(=O)N3)N=CC4=CC(=CC=C4)OC5=CC=CC=C5

InChI

InChI=1S/C27H22N4O3S/c1-2-13-28-27-31(24(18-35-27)20-11-12-25-23(15-20)30-26(32)17-33-25)29-16-19-7-6-10-22(14-19)34-21-8-4-3-5-9-21/h2-12,14-16,18H,1,13,17H2,(H,30,32)