4-azanyl-N-[3-[2,4-bis(2-methylbutan-2-yl)phenoxy]propyl]-1-methylsulfonyl-naphthalene-2-carboxamide

Systemtic Name: 4-azanyl-N-[3-[2,4-bis(2-methylbutan-2-yl)phenoxy]propyl]-1-methylsulfonyl-naphthalene-2-carboxamide Openeye Name: 4-amino-N-[3-[2,4-bis(1,1-dimethylpropyl)phenoxy]propyl]-1-methylsulfonyl-naphthalene-2-carboxamide CAS Name: 4-amino-N-[3-[2,4-bis(2-methylbutan-2-yl)phenoxy]propyl]-1-methylsulfonyl-2-naphthalenecarboxamide IUPAC Name: 4-amino-N-[3-[2,4-bis(2-methylbutan-2-yl)phenoxy]propyl]-1-methylsulfonylnaphthalene-2-carboxamide Traditional Name: 4-amino-N-[3-(2,4-ditert-amylphenoxy)propyl]-1-mesyl-2-naphthamide Formula: C31H42N2O4S MolecularWeight: 538.74118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCCNC(=O)C2=C(C3=CC=CC=C3C(=C2)N)S(=O)(=O)C)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCCNC(=O)C2=C(C3=CC=CC=C3C(=C2)N)S(=O)(=O)C)C(C)(C)CC

InChI

InChI=1S/C31H42N2O4S/c1-8-30(3,4)21-15-16-27(25(19-21)31(5,6)9-2)37-18-12-17-33-29(34)24-20-26(32)22-13-10-11-14-23(22)28(24)38(7,35)36/h10-11,13-16,19-20H,8-9,12,17-18,32H2,1-7H3,(H,33,34)