1-(1,3-benzothiazol-2-ylmethyl)-1-methyl-3-[(2-morpholin-4-ylsulfonylphenyl)methyl]urea

Systemtic Name: 1-(1,3-benzothiazol-2-ylmethyl)-1-methyl-3-[(2-morpholin-4-ylsulfonylphenyl)methyl]urea Openeye Name: 1-(1,3-benzothiazol-2-ylmethyl)-1-methyl-3-[(2-morpholinosulfonylphenyl)methyl]urea CAS Name: 1-(1,3-benzothiazol-2-ylmethyl)-1-methyl-3-[[2-(4-morpholinylsulfonyl)phenyl]methyl]urea IUPAC Name: 1-(1,3-benzothiazol-2-ylmethyl)-1-methyl-3-[(2-morpholin-4-ylsulfonylphenyl)methyl]urea Traditional Name: 1-(1,3-benzothiazol-2-ylmethyl)-1-methyl-3-(2-morpholinosulfonylbenzyl)urea Formula: C21H24N4O4S2 MolecularWeight: 460.56966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=O)NCC3=CC=CC=C3S(=O)(=O)N4CCOCC4

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=O)NCC3=CC=CC=C3S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H24N4O4S2/c1-24(15-20-23-17-7-3-4-8-18(17)30-20)21(26)22-14-16-6-2-5-9-19(16)31(27,28)25-10-12-29-13-11-25/h2-9H,10-15H2,1H3,(H,22,26)