1-[4-methoxy-2-(phenylsulfonylamino)-1,3-benzothiazol-6-yl]-3-phenethyl-urea

Systemtic Name: 1-[4-methoxy-2-(phenylsulfonylamino)-1,3-benzothiazol-6-yl]-3-phenethyl-urea Openeye Name: 1-[2-(benzenesulfonamido)-4-methoxy-1,3-benzothiazol-6-yl]-3-phenethyl-urea CAS Name: 1-[2-(benzenesulfonamido)-4-methoxy-1,3-benzothiazol-6-yl]-3-phenethylurea IUPAC Name: 1-[2-(benzenesulfonamido)-4-methoxy-1,3-benzothiazol-6-yl]-3-phenethylurea Traditional Name: 1-[2-(benzenesulfonamido)-4-methoxy-1,3-benzothiazol-6-yl]-3-phenethyl-urea Formula: C23H22N4O4S2 MolecularWeight: 482.57518

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)NC(=O)NCCC3=CC=CC=C3)SC(=N2)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=C2C(=CC(=C1)NC(=O)NCCC3=CC=CC=C3)SC(=N2)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H22N4O4S2/c1-31-19-14-17(25-22(28)24-13-12-16-8-4-2-5-9-16)15-20-21(19)26-23(32-20)27-33(29,30)18-10-6-3-7-11-18/h2-11,14-15H,12-13H2,1H3,(H,26,27)(H2,24,25,28)