6-[3-(5-methylhexan-2-ylideneamino)-2-prop-2-enylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[3-(5-methylhexan-2-ylideneamino)-2-prop-2-enylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-allylimino-3-(1,4-dimethylpentylideneamino)thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-(5-methylhexan-2-ylideneamino)-2-prop-2-enylimino-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-(5-methylhexan-2-ylideneamino)-2-prop-2-enylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-allylimino-3-(1,4-dimethylpentylideneamino)-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=NN1C(=CSC1=NCC=C)C2=CC3=C(C=C2)OCC(=O)N3)C

Isomeric SMILES

CC(C)CCC(=NN1C(=CSC1=NCC=C)C2=CC3=C(C=C2)OCC(=O)N3)C

InChI

InChI=1S/C21H26N4O2S/c1-5-10-22-21-25(24-15(4)7-6-14(2)3)18(13-28-21)16-8-9-19-17(11-16)23-20(26)12-27-19/h5,8-9,11,13-14H,1,6-7,10,12H2,2-4H3,(H,23,26)