N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide Openeye Name: N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide CAS Name: N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide IUPAC Name: N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide Traditional Name: N-[2-(1,3-benzothiazol-2-ylamino)ethyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide Formula: C22H19N5O5S2 MolecularWeight: 497.54676

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NCCNC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NCCNC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H19N5O5S2/c28-21(23-12-13-24-22-25-19-6-1-2-7-20(19)33-22)15-8-10-16(11-9-15)26-34(31,32)18-5-3-4-17(14-18)27(29)30/h1-11,14,26H,12-13H2,(H,23,28)(H,24,25)