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

Systemtic Name: [2-[2-[(4-azanyl-4-phenyl-butyl)-cyclopentyl-amino]-2-[(3-butyl-6-chloranyl-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonyl]ethanoyl]oxy-2-oxidanylidene-ethyl]-oxidanyl-oxidanylidene-phosphanium Openeye Name: [2-[2-[(4-amino-4-phenyl-butyl)-cyclopentyl-amino]-2-[(3-butyl-6-chloro-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonyl]acetyl]oxy-2-oxo-ethyl]-hydroxy-oxo-phosphonium CAS Name: [2-[2-[(4-amino-4-phenylbutyl)-cyclopentylamino]-2-[(3-butyl-6-chloro-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonyl]-1-oxoethoxy]-2-oxoethyl]-hydroxy-oxophosphonium IUPAC Name: [2-[2-[(4-amino-4-phenylbutyl)-cyclopentylamino]-2-[(3-butyl-6-chloro-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonyl]acetyl]oxy-2-oxoethyl]-hydroxy-oxophosphanium Traditional Name: [2-[2-[(4-amino-4-phenyl-butyl)-cyclopentyl-amino]-2-[(3-butyl-6-chloro-3,4-dihydro-2H-1,2,4-benzothiadiazin-7-yl)sulfonyl]acetyl]oxy-2-keto-ethyl]-hydroxy-keto-phosphonium Formula: C30H41ClN4O7PS2+ MolecularWeight: 700.225901

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1NC2=CC(=C(C=C2SN1)S(=O)(=O)C(C(=O)OC(=O)C[P+](=O)O)N(CCCC(C3=CC=CC=C3)N)C4CCCC4)Cl

Isomeric SMILES

CCCCC1NC2=CC(=C(C=C2SN1)S(=O)(=O)C(C(=O)OC(=O)C[P+](=O)O)N(CCCC(C3=CC=CC=C3)N)C4CCCC4)Cl

InChI

InChI=1S/C30H40ClN4O7PS2/c1-2-3-15-27-33-24-17-22(31)26(18-25(24)44-34-27)45(40,41)29(30(37)42-28(36)19-43(38)39)35(21-12-7-8-13-21)16-9-14-23(32)20-10-5-4-6-11-20/h4-6,10-11,17-18,21,23,27,29,33-34H,2-3,7-9,12-16,19,32H2,1H3/p+1