[6-azanyl-2-[(3-butyl-6-chloranyl-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonyl]-1-oxidanylidene-6-phenyl-hexan-2-yl]-oxidanyl-oxidanylidene-phosphanium

Systemtic Name: [6-azanyl-2-[(3-butyl-6-chloranyl-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonyl]-1-oxidanylidene-6-phenyl-hexan-2-yl]-oxidanyl-oxidanylidene-phosphanium Openeye Name: [5-amino-1-[(3-butyl-6-chloro-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonyl]-1-formyl-5-phenyl-pentyl]-hydroxy-oxo-phosphonium CAS Name: [6-amino-2-[(3-butyl-6-chloro-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonyl]-1-oxo-6-phenylhexan-2-yl]-hydroxy-oxophosphonium IUPAC Name: [6-amino-2-[(3-butyl-6-chloro-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonyl]-1-oxo-6-phenylhexan-2-yl]-hydroxy-oxophosphanium Traditional Name: [5-amino-1-[(3-butyl-6-chloro-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonyl]-1-formyl-5-phenyl-pentyl]-hydroxy-keto-phosphonium Formula: C23H30ClN3O5PS2+ MolecularWeight: 559.058161

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1NC2=CC(=C(C=C2SN1)S(=O)(=O)C(CCCC(C3=CC=CC=C3)N)(C=O)[P+](=O)O)Cl

Isomeric SMILES

CCCCC1NC2=CC(=C(C=C2SN1)S(=O)(=O)C(CCCC(C3=CC=CC=C3)N)(C=O)[P+](=O)O)Cl

InChI

InChI=1S/C23H29ClN3O5PS2/c1-2-3-11-22-26-19-13-17(24)21(14-20(19)34-27-22)35(31,32)23(15-28,33(29)30)12-7-10-18(25)16-8-5-4-6-9-16/h4-6,8-9,13-15,18,22,26-27H,2-3,7,10-12,25H2,1H3/p+1