1-[2-(methylsulfonylamino)-1,3-benzothiazol-5-yl]-3-(phenylmethyl)urea

Systemtic Name: 1-[2-(methylsulfonylamino)-1,3-benzothiazol-5-yl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[2-(methanesulfonamido)-1,3-benzothiazol-5-yl]urea CAS Name: 1-[2-(methanesulfonamido)-1,3-benzothiazol-5-yl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[2-(methanesulfonamido)-1,3-benzothiazol-5-yl]urea Traditional Name: 1-benzyl-3-[2-(methanesulfonamido)-1,3-benzothiazol-5-yl]urea Formula: C16H16N4O3S2 MolecularWeight: 376.45324

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=NC2=C(S1)C=CC(=C2)NC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)NC1=NC2=C(S1)C=CC(=C2)NC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C16H16N4O3S2/c1-25(22,23)20-16-19-13-9-12(7-8-14(13)24-16)18-15(21)17-10-11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,19,20)(H2,17,18,21)