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

Systemtic Name: 6-[3-(cycloheptylideneamino)-2-prop-2-enylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-allylimino-3-(cycloheptylideneamino)thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-(cycloheptylideneamino)-2-prop-2-enylimino-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-(cycloheptylideneamino)-2-prop-2-enylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-allylimino-3-(cycloheptylideneamino)-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN=C1N(C(=CS1)C2=CC3=C(C=C2)OCC(=O)N3)N=C4CCCCCC4

Isomeric SMILES

C=CCN=C1N(C(=CS1)C2=CC3=C(C=C2)OCC(=O)N3)N=C4CCCCCC4

InChI

InChI=1S/C21H24N4O2S/c1-2-11-22-21-25(24-16-7-5-3-4-6-8-16)18(14-28-21)15-9-10-19-17(12-15)23-20(26)13-27-19/h2,9-10,12,14H,1,3-8,11,13H2,(H,23,26)