cyclohexyl-methyl-[3-[[4-[(3-oxidanylidene-4H-1,4-benzothiazin-2-ylidene)methyl]phenyl]carbonylamino]propyl]azanium

Systemtic Name: cyclohexyl-methyl-[3-[[4-[(3-oxidanylidene-4H-1,4-benzothiazin-2-ylidene)methyl]phenyl]carbonylamino]propyl]azanium Openeye Name: cyclohexyl-methyl-[3-[[4-[(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]benzoyl]amino]propyl]ammonium CAS Name: cyclohexyl-methyl-[3-[[oxo-[4-[(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]phenyl]methyl]amino]propyl]ammonium IUPAC Name: cyclohexyl-methyl-[3-[[4-[(3-oxo-4H-1,4-benzothiazin-2-ylidene)methyl]benzoyl]amino]propyl]azanium Traditional Name: cyclohexyl-[3-[[4-[(3-keto-4H-1,4-benzothiazin-2-ylidene)methyl]benzoyl]amino]propyl]-methyl-ammonium Formula: C26H32N3O2S+ MolecularWeight: 450.61618

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCNC(=O)C1=CC=C(C=C1)C=C2C(=O)NC3=CC=CC=C3S2)C4CCCCC4

Isomeric SMILES

C[NH+](CCCNC(=O)C1=CC=C(C=C1)C=C2C(=O)NC3=CC=CC=C3S2)C4CCCCC4

InChI

InChI=1S/C26H31N3O2S/c1-29(21-8-3-2-4-9-21)17-7-16-27-25(30)20-14-12-19(13-15-20)18-24-26(31)28-22-10-5-6-11-23(22)32-24/h5-6,10-15,18,21H,2-4,7-9,16-17H2,1H3,(H,27,30)(H,28,31)/p+1