6-[3-[(4-chloranyl-3-nitro-phenyl)methylideneamino]-2-ethylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[3-[(4-chloranyl-3-nitro-phenyl)methylideneamino]-2-ethylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-[(4-chloro-3-nitro-phenyl)methyleneamino]-2-ethylimino-thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-[(4-chloro-3-nitrophenyl)methylideneamino]-2-ethylimino-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-[(4-chloro-3-nitrophenyl)methylideneamino]-2-ethylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-[(4-chloro-3-nitro-benzylidene)amino]-2-ethylimino-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C20H16ClN5O4S MolecularWeight: 457.89014

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C1N(C(=CS1)C2=CC3=C(C=C2)OCC(=O)N3)N=CC4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CCN=C1N(C(=CS1)C2=CC3=C(C=C2)OCC(=O)N3)N=CC4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H16ClN5O4S/c1-2-22-20-25(23-9-12-3-5-14(21)16(7-12)26(28)29)17(11-31-20)13-4-6-18-15(8-13)24-19(27)10-30-18/h3-9,11H,2,10H2,1H3,(H,24,27)