N-[4-[3-(dimethylaminomethyl)-6-propan-2-yl-azulen-1-yl]butyl]benzenesulfonamide

Systemtic Name: N-[4-[3-(dimethylaminomethyl)-6-propan-2-yl-azulen-1-yl]butyl]benzenesulfonamide Openeye Name: N-[4-[3-(dimethylaminomethyl)-6-isopropyl-azulen-1-yl]butyl]benzenesulfonamide CAS Name: N-[4-[3-(dimethylaminomethyl)-6-propan-2-yl-1-azulenyl]butyl]benzenesulfonamide IUPAC Name: N-[4-[3-(dimethylaminomethyl)-6-propan-2-ylazulen-1-yl]butyl]benzenesulfonamide Traditional Name: N-[4-[3-(dimethylaminomethyl)-6-isopropyl-azulen-1-yl]butyl]benzenesulfonamide Formula: C26H34N2O2S MolecularWeight: 438.62536

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C2C(=C(C=C2CN(C)C)CCCCNS(=O)(=O)C3=CC=CC=C3)C=C1

Isomeric SMILES

CC(C)C1=CC=C2C(=C(C=C2CN(C)C)CCCCNS(=O)(=O)C3=CC=CC=C3)C=C1

InChI

InChI=1S/C26H34N2O2S/c1-20(2)21-13-15-25-22(18-23(19-28(3)4)26(25)16-14-21)10-8-9-17-27-31(29,30)24-11-6-5-7-12-24/h5-7,11-16,18,20,27H,8-10,17,19H2,1-4H3