N-(5-bromanyl-2-methoxy-phenyl)sulfonyl-3-[2-(naphthalen-2-ylmethyl)-4-(pyrazol-1-ylmethyl)phenyl]propanamide

Systemtic Name: N-(5-bromanyl-2-methoxy-phenyl)sulfonyl-3-[2-(naphthalen-2-ylmethyl)-4-(pyrazol-1-ylmethyl)phenyl]propanamide Openeye Name: N-(5-bromo-2-methoxy-phenyl)sulfonyl-3-[2-(2-naphthylmethyl)-4-(pyrazol-1-ylmethyl)phenyl]propanamide CAS Name: N-(5-bromo-2-methoxyphenyl)sulfonyl-3-[2-(2-naphthalenylmethyl)-4-(1-pyrazolylmethyl)phenyl]propanamide IUPAC Name: N-(5-bromo-2-methoxyphenyl)sulfonyl-3-[2-(naphthalen-2-ylmethyl)-4-(pyrazol-1-ylmethyl)phenyl]propanamide Traditional Name: N-(5-bromo-2-methoxy-phenyl)sulfonyl-3-[2-(2-naphthylmethyl)-4-(pyrazol-1-ylmethyl)phenyl]propionamide Formula: C31H28BrN3O4S MolecularWeight: 618.54072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)S(=O)(=O)NC(=O)CCC2=C(C=C(C=C2)CN3C=CC=N3)CC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)S(=O)(=O)NC(=O)CCC2=C(C=C(C=C2)CN3C=CC=N3)CC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C31H28BrN3O4S/c1-39-29-13-12-28(32)20-30(29)40(37,38)34-31(36)14-11-25-10-8-23(21-35-16-4-15-33-35)19-27(25)18-22-7-9-24-5-2-3-6-26(24)17-22/h2-10,12-13,15-17,19-20H,11,14,18,21H2,1H3,(H,34,36)