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

Systemtic Name: 6-[3-(3-imidazol-1-ylpropyl)-2-(4-morpholin-4-ylsulfonylphenyl)imino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[3-(3-imidazol-1-ylpropyl)-2-(4-morpholinosulfonylphenyl)imino-thiazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-[3-(1-imidazolyl)propyl]-2-[4-(4-morpholinylsulfonyl)phenyl]imino-4-thiazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[3-(3-imidazol-1-ylpropyl)-2-(4-morpholin-4-ylsulfonylphenyl)imino-1,3-thiazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-(3-imidazol-1-ylpropyl)-2-(4-morpholinosulfonylphenyl)imino-4-thiazolin-4-yl]-4H-1,4-benzoxazin-3-one Formula: C27H28N6O5S2 MolecularWeight: 580.67842

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)N=C3N(C(=CS3)C4=CC5=C(C=C4)OCC(=O)N5)CCCN6C=CN=C6

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)N=C3N(C(=CS3)C4=CC5=C(C=C4)OCC(=O)N5)CCCN6C=CN=C6

InChI

InChI=1S/C27H28N6O5S2/c34-26-17-38-25-7-2-20(16-23(25)30-26)24-18-39-27(33(24)10-1-9-31-11-8-28-19-31)29-21-3-5-22(6-4-21)40(35,36)32-12-14-37-15-13-32/h2-8,11,16,18-19H,1,9-10,12-15,17H2,(H,30,34)