1-[[4-(1,3-benzoxazol-2-ylsulfanylmethyl)phenyl]carbonylamino]-3-(4-methylphenyl)sulfonyl-urea

Systemtic Name: 1-[[4-(1,3-benzoxazol-2-ylsulfanylmethyl)phenyl]carbonylamino]-3-(4-methylphenyl)sulfonyl-urea Openeye Name: 1-[[4-(1,3-benzoxazol-2-ylsulfanylmethyl)benzoyl]amino]-3-(p-tolylsulfonyl)urea CAS Name: 1-[[[4-[(1,3-benzoxazol-2-ylthio)methyl]phenyl]-oxomethyl]amino]-3-(4-methylphenyl)sulfonylurea IUPAC Name: 1-[[4-(1,3-benzoxazol-2-ylsulfanylmethyl)benzoyl]amino]-3-(4-methylphenyl)sulfonylurea Traditional Name: 1-[[4-[(1,3-benzoxazol-2-ylthio)methyl]benzoyl]amino]-3-tosyl-urea Formula: C23H20N4O5S2 MolecularWeight: 496.5587

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NNC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C23H20N4O5S2/c1-15-6-12-18(13-7-15)34(30,31)27-22(29)26-25-21(28)17-10-8-16(9-11-17)14-33-23-24-19-4-2-3-5-20(19)32-23/h2-13H,14H2,1H3,(H,25,28)(H2,26,27,29)