N-[3-oxidanylidene-2-[2-(propan-2-ylamino)phenyl]sulfanyl-1,2-dihydroinden-5-yl]hexadecane-1-sulfonamide

Systemtic Name: N-[3-oxidanylidene-2-[2-(propan-2-ylamino)phenyl]sulfanyl-1,2-dihydroinden-5-yl]hexadecane-1-sulfonamide Openeye Name: N-[2-[2-(isopropylamino)phenyl]sulfanyl-3-oxo-indan-5-yl]hexadecane-1-sulfonamide CAS Name: N-[3-oxo-2-[[2-(propan-2-ylamino)phenyl]thio]-1,2-dihydroinden-5-yl]-1-hexadecanesulfonamide IUPAC Name: N-[3-oxo-2-[2-(propan-2-ylamino)phenyl]sulfanyl-1,2-dihydroinden-5-yl]hexadecane-1-sulfonamide Traditional Name: N-[2-[[2-(isopropylamino)phenyl]thio]-3-keto-indan-5-yl]hexadecane-1-sulfonamide Formula: C34H52N2O3S2 MolecularWeight: 600.91828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCS(=O)(=O)NC1=CC2=C(CC(C2=O)SC3=CC=CC=C3NC(C)C)C=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCS(=O)(=O)NC1=CC2=C(CC(C2=O)SC3=CC=CC=C3NC(C)C)C=C1

InChI

InChI=1S/C34H52N2O3S2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24-41(38,39)36-29-23-22-28-25-33(34(37)30(28)26-29)40-32-21-18-17-20-31(32)35-27(2)3/h17-18,20-23,26-27,33,35-36H,4-16,19,24-25H2,1-3H3