N-[1,2-bis[4-(diethylaminomethyl)phenyl]ethyl]-3-(naphthalen-2-ylsulfonylamino)-3-phenyl-propanamide

Systemtic Name: N-[1,2-bis[4-(diethylaminomethyl)phenyl]ethyl]-3-(naphthalen-2-ylsulfonylamino)-3-phenyl-propanamide Openeye Name: N-[1,2-bis[4-(diethylaminomethyl)phenyl]ethyl]-3-(2-naphthylsulfonylamino)-3-phenyl-propanamide CAS Name: N-[1,2-bis[4-(diethylaminomethyl)phenyl]ethyl]-3-(2-naphthalenylsulfonylamino)-3-phenylpropanamide IUPAC Name: N-[1,2-bis[4-(diethylaminomethyl)phenyl]ethyl]-3-(naphthalen-2-ylsulfonylamino)-3-phenylpropanamide Traditional Name: N-[1,2-bis[4-(diethylaminomethyl)phenyl]ethyl]-3-(2-naphthylsulfonylamino)-3-phenyl-propionamide Formula: C43H52N4O3S MolecularWeight: 704.96298

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=C(C=C1)CC(C2=CC=C(C=C2)CN(CC)CC)NC(=O)CC(C3=CC=CC=C3)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CCN(CC)CC1=CC=C(C=C1)CC(C2=CC=C(C=C2)CN(CC)CC)NC(=O)CC(C3=CC=CC=C3)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C43H52N4O3S/c1-5-46(6-2)31-34-20-18-33(19-21-34)28-41(38-24-22-35(23-25-38)32-47(7-3)8-4)44-43(48)30-42(37-15-10-9-11-16-37)45-51(49,50)40-27-26-36-14-12-13-17-39(36)29-40/h9-27,29,41-42,45H,5-8,28,30-32H2,1-4H3,(H,44,48)