6-[2-(4-ethylphenyl)imino-3-(1-phenylethyl)-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-(4-ethylphenyl)imino-3-(1-phenylethyl)-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(4-ethylphenyl)imino-3-(1-phenylethyl)thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[2-(4-ethylphenyl)imino-3-(1-phenylethyl)-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(4-ethylphenyl)imino-3-(1-phenylethyl)-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-(4-ethylphenyl)imino-3-(1-phenylethyl)-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C27H25N3O2S MolecularWeight: 455.5713

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N=C2N(C(=CS2)C3=CC4=C(C=C3)OCC(=O)N4)C(C)C5=CC=CC=C5

Isomeric SMILES

CCC1=CC=C(C=C1)N=C2N(C(=CS2)C3=CC4=C(C=C3)OCC(=O)N4)C(C)C5=CC=CC=C5

InChI

InChI=1S/C27H25N3O2S/c1-3-19-9-12-22(13-10-19)28-27-30(18(2)20-7-5-4-6-8-20)24(17-33-27)21-11-14-25-23(15-21)29-26(31)16-32-25/h4-15,17-18H,3,16H2,1-2H3,(H,29,31)