N-[2-methyl-3-[[4-(3-pent-3-ynoxyphenoxy)phenyl]methyl-(phenylmethyl)amino]phenyl]methanesulfonamide

Systemtic Name: N-[2-methyl-3-[[4-(3-pent-3-ynoxyphenoxy)phenyl]methyl-(phenylmethyl)amino]phenyl]methanesulfonamide Openeye Name: N-[3-[benzyl-[[4-(3-pent-3-ynoxyphenoxy)phenyl]methyl]amino]-2-methyl-phenyl]methanesulfonamide CAS Name: N-[2-methyl-3-[[4-(3-pent-3-ynoxyphenoxy)phenyl]methyl-(phenylmethyl)amino]phenyl]methanesulfonamide IUPAC Name: N-[3-[benzyl-[[4-(3-pent-3-ynoxyphenoxy)phenyl]methyl]amino]-2-methylphenyl]methanesulfonamide Traditional Name: N-[3-[benzyl-[4-(3-pent-3-ynoxyphenoxy)benzyl]amino]-2-methyl-phenyl]methanesulfonamide Formula: C33H34N2O4S MolecularWeight: 554.69906

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCCOC1=CC=CC(=C1)OC2=CC=C(C=C2)CN(CC3=CC=CC=C3)C4=CC=CC(=C4C)NS(=O)(=O)C

Isomeric SMILES

CC#CCCOC1=CC=CC(=C1)OC2=CC=C(C=C2)CN(CC3=CC=CC=C3)C4=CC=CC(=C4C)NS(=O)(=O)C

InChI

InChI=1S/C33H34N2O4S/c1-4-5-9-22-38-30-14-10-15-31(23-30)39-29-20-18-28(19-21-29)25-35(24-27-12-7-6-8-13-27)33-17-11-16-32(26(33)2)34-40(3,36)37/h6-8,10-21,23,34H,9,22,24-25H2,1-3H3