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

Systemtic Name: 6-[3-(cycloheptylideneamino)-2-phenethylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-(cycloheptylideneamino)-2-phenethylimino-thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-(cycloheptylideneamino)-2-phenethylimino-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-(cycloheptylideneamino)-2-phenethylimino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-(cycloheptylideneamino)-2-phenethylimino-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C26H28N4O2S MolecularWeight: 460.59112

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(=NN2C(=CSC2=NCCC3=CC=CC=C3)C4=CC5=C(C=C4)OCC(=O)N5)CC1

Isomeric SMILES

C1CCCC(=NN2C(=CSC2=NCCC3=CC=CC=C3)C4=CC5=C(C=C4)OCC(=O)N5)CC1

InChI

InChI=1S/C26H28N4O2S/c31-25-17-32-24-13-12-20(16-22(24)28-25)23-18-33-26(27-15-14-19-8-4-3-5-9-19)30(23)29-21-10-6-1-2-7-11-21/h3-5,8-9,12-13,16,18H,1-2,6-7,10-11,14-15,17H2,(H,28,31)