N-[4-[[3-bromanyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylamino]phenyl]ethanamide

Systemtic Name: N-[4-[[3-bromanyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylamino]phenyl]ethanamide Openeye Name: N-[4-[[3-bromo-5-methoxy-4-(2-thienylmethoxy)phenyl]methylamino]phenyl]acetamide CAS Name: N-[4-[[3-bromo-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylamino]phenyl]acetamide IUPAC Name: N-[4-[[3-bromo-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylamino]phenyl]acetamide Traditional Name: N-[4-[[3-bromo-5-methoxy-4-(2-thenyloxy)benzyl]amino]phenyl]acetamide Formula: C21H21BrN2O3S MolecularWeight: 461.37204

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NCC2=CC(=C(C(=C2)Br)OCC3=CC=CS3)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NCC2=CC(=C(C(=C2)Br)OCC3=CC=CS3)OC

InChI

InChI=1S/C21H21BrN2O3S/c1-14(25)24-17-7-5-16(6-8-17)23-12-15-10-19(22)21(20(11-15)26-2)27-13-18-4-3-9-28-18/h3-11,23H,12-13H2,1-2H3,(H,24,25)