6-[3-(3-methylbutylideneamino)-2-(4-morpholin-4-ylsulfonylphenyl)imino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[3-(3-methylbutylideneamino)-2-(4-morpholin-4-ylsulfonylphenyl)imino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-(3-methylbutylideneamino)-2-(4-morpholinosulfonylphenyl)imino-thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-(3-methylbutylideneamino)-2-[4-(4-morpholinylsulfonyl)phenyl]imino-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-(3-methylbutylideneamino)-2-(4-morpholin-4-ylsulfonylphenyl)imino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-(3-methylbutylideneamino)-2-(4-morpholinosulfonylphenyl)imino-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C26H29N5O5S2 MolecularWeight: 555.66896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC=NN1C(=CSC1=NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C4=CC5=C(C=C4)OCC(=O)N5

Isomeric SMILES

CC(C)CC=NN1C(=CSC1=NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C4=CC5=C(C=C4)OCC(=O)N5

InChI

InChI=1S/C26H29N5O5S2/c1-18(2)9-10-27-31-23(19-3-8-24-22(15-19)29-25(32)16-36-24)17-37-26(31)28-20-4-6-21(7-5-20)38(33,34)30-11-13-35-14-12-30/h3-8,10,15,17-18H,9,11-14,16H2,1-2H3,(H,29,32)