6-[3-(hexan-2-ylideneamino)-2-pyridin-3-ylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[3-(hexan-2-ylideneamino)-2-pyridin-3-ylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-(1-methylpentylideneamino)-2-(3-pyridylimino)thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-(hexan-2-ylideneamino)-2-(3-pyridinylimino)-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-(hexan-2-ylideneamino)-2-pyridin-3-ylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-(1-methylpentylideneamino)-2-(3-pyridylimino)-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C22H23N5O2S MolecularWeight: 421.51532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=NN1C(=CSC1=NC2=CN=CC=C2)C3=CC4=C(C=C3)OCC(=O)N4)C

Isomeric SMILES

CCCCC(=NN1C(=CSC1=NC2=CN=CC=C2)C3=CC4=C(C=C3)OCC(=O)N4)C

InChI

InChI=1S/C22H23N5O2S/c1-3-4-6-15(2)26-27-19(14-30-22(27)24-17-7-5-10-23-12-17)16-8-9-20-18(11-16)25-21(28)13-29-20/h5,7-12,14H,3-4,6,13H2,1-2H3,(H,25,28)