2-[3-[4-(heptylamino)phenyl]quinolin-2-yl]sulfanylethanal

Systemtic Name: 2-[3-[4-(heptylamino)phenyl]quinolin-2-yl]sulfanylethanal Openeye Name: 2-[[3-[4-(heptylamino)phenyl]-2-quinolyl]sulfanyl]acetaldehyde CAS Name: 2-[[3-[4-(heptylamino)phenyl]-2-quinolinyl]thio]acetaldehyde IUPAC Name: 2-[3-[4-(heptylamino)phenyl]quinolin-2-yl]sulfanylacetaldehyde Traditional Name: 2-[[3-[4-(heptylamino)phenyl]-2-quinolyl]thio]acetaldehyde Formula: C24H28N2OS MolecularWeight: 392.55692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC1=CC=C(C=C1)C2=CC3=CC=CC=C3N=C2SCC=O

Isomeric SMILES

CCCCCCCNC1=CC=C(C=C1)C2=CC3=CC=CC=C3N=C2SCC=O

InChI

InChI=1S/C24H28N2OS/c1-2-3-4-5-8-15-25-21-13-11-19(12-14-21)22-18-20-9-6-7-10-23(20)26-24(22)28-17-16-27/h6-7,9-14,16,18,25H,2-5,8,15,17H2,1H3