diethyl-[2-[(5-methoxy-1,3-benzothiazol-2-yl)-(4-piperidin-1-ylsulfonylphenyl)carbonyl-amino]ethyl]azanium

Systemtic Name: diethyl-[2-[(5-methoxy-1,3-benzothiazol-2-yl)-(4-piperidin-1-ylsulfonylphenyl)carbonyl-amino]ethyl]azanium Openeye Name: diethyl-[2-[(5-methoxy-1,3-benzothiazol-2-yl)-[4-(1-piperidylsulfonyl)benzoyl]amino]ethyl]ammonium CAS Name: diethyl-[2-[(5-methoxy-1,3-benzothiazol-2-yl)-[oxo-[4-(1-piperidinylsulfonyl)phenyl]methyl]amino]ethyl]ammonium IUPAC Name: diethyl-[2-[(5-methoxy-1,3-benzothiazol-2-yl)-(4-piperidin-1-ylsulfonylbenzoyl)amino]ethyl]azanium Traditional Name: diethyl-[2-[(5-methoxy-1,3-benzothiazol-2-yl)-(4-piperidinosulfonylbenzoyl)amino]ethyl]ammonium Formula: C26H35N4O4S2+ MolecularWeight: 531.7105

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(C1=NC2=C(S1)C=CC(=C2)OC)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC[NH+](CC)CCN(C1=NC2=C(S1)C=CC(=C2)OC)C(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C26H34N4O4S2/c1-4-28(5-2)17-18-30(26-27-23-19-21(34-3)11-14-24(23)35-26)25(31)20-9-12-22(13-10-20)36(32,33)29-15-7-6-8-16-29/h9-14,19H,4-8,15-18H2,1-3H3/p+1