5-[[3-bromanyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylamino]-1,3-dihydrobenzimidazol-2-one

Systemtic Name: 5-[[3-bromanyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylamino]-1,3-dihydrobenzimidazol-2-one Openeye Name: 5-[[3-bromo-5-methoxy-4-(2-thienylmethoxy)phenyl]methylamino]-1,3-dihydrobenzimidazol-2-one CAS Name: 5-[[3-bromo-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylamino]-1,3-dihydrobenzimidazol-2-one IUPAC Name: 5-[[3-bromo-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylamino]-1,3-dihydrobenzimidazol-2-one Traditional Name: 5-[[3-bromo-5-methoxy-4-(2-thenyloxy)benzyl]amino]-1,3-dihydrobenzimidazol-2-one Formula: C20H18BrN3O3S MolecularWeight: 460.34422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNC2=CC3=C(C=C2)NC(=O)N3)Br)OCC4=CC=CS4

Isomeric SMILES

COC1=C(C(=CC(=C1)CNC2=CC3=C(C=C2)NC(=O)N3)Br)OCC4=CC=CS4

InChI

InChI=1S/C20H18BrN3O3S/c1-26-18-8-12(7-15(21)19(18)27-11-14-3-2-6-28-14)10-22-13-4-5-16-17(9-13)24-20(25)23-16/h2-9,22H,10-11H2,1H3,(H2,23,24,25)