[2-methoxy-4-[[4-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-2-phenethylimino-1,3-thiazol-3-yl]iminomethyl]phenyl] cyclopropanecarboxylate

Systemtic Name: [2-methoxy-4-[[4-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)-2-phenethylimino-1,3-thiazol-3-yl]iminomethyl]phenyl] cyclopropanecarboxylate Openeye Name: [2-methoxy-4-[[4-(3-oxo-4H-1,4-benzoxazin-6-yl)-2-phenethylimino-thiazol-3-yl]iminomethyl]phenyl] cyclopropanecarboxylate CAS Name: cyclopropanecarboxylic acid [2-methoxy-4-[[4-(3-oxo-4H-1,4-benzoxazin-6-yl)-2-phenethylimino-3-thiazolyl]iminomethyl]phenyl] ester IUPAC Name: [2-methoxy-4-[[4-(3-oxo-4H-1,4-benzoxazin-6-yl)-2-phenethylimino-1,3-thiazol-3-yl]iminomethyl]phenyl] cyclopropanecarboxylate Traditional Name: cyclopropanecarboxylic acid [4-[[4-(3-keto-4H-1,4-benzoxazin-6-yl)-2-phenethylimino-4-thiazolin-3-yl]iminomethyl]-2-methoxy-phenyl] ester Formula: C31H28N4O5S MolecularWeight: 568.64282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NN2C(=CSC2=NCCC3=CC=CC=C3)C4=CC5=C(C=C4)OCC(=O)N5)OC(=O)C6CC6

Isomeric SMILES

COC1=C(C=CC(=C1)C=NN2C(=CSC2=NCCC3=CC=CC=C3)C4=CC5=C(C=C4)OCC(=O)N5)OC(=O)C6CC6

InChI

InChI=1S/C31H28N4O5S/c1-38-28-15-21(7-11-27(28)40-30(37)22-8-9-22)17-33-35-25(23-10-12-26-24(16-23)34-29(36)18-39-26)19-41-31(35)32-14-13-20-5-3-2-4-6-20/h2-7,10-12,15-17,19,22H,8-9,13-14,18H2,1H3,(H,34,36)