4-methyl-N-(phenylmethyl)-N-[(E)-13-pyridin-3-yltetradec-2-enyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-(phenylmethyl)-N-[(E)-13-pyridin-3-yltetradec-2-enyl]benzenesulfonamide Openeye Name: N-benzyl-4-methyl-N-[(E)-13-(3-pyridyl)tetradec-2-enyl]benzenesulfonamide CAS Name: 4-methyl-N-(phenylmethyl)-N-[(E)-13-(3-pyridinyl)tetradec-2-enyl]benzenesulfonamide IUPAC Name: N-benzyl-4-methyl-N-[(E)-13-pyridin-3-yltetradec-2-enyl]benzenesulfonamide Traditional Name: N-benzyl-4-methyl-N-[(E)-13-(3-pyridyl)tetradec-2-enyl]benzenesulfonamide Formula: C33H44N2O2S MolecularWeight: 532.77966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC=CCCCCCCCCCC(C)C2=CN=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C/C=C/CCCCCCCCCC(C)C2=CN=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C33H44N2O2S/c1-29-21-23-33(24-22-29)38(36,37)35(28-31-18-13-11-14-19-31)26-15-10-8-6-4-3-5-7-9-12-17-30(2)32-20-16-25-34-27-32/h10-11,13-16,18-25,27,30H,3-9,12,17,26,28H2,1-2H3/b15-10+