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4-(pentylamino)-2-phenanthren-9-ylsulfanyl-butanamide

4-(pentylamino)-2-phenanthren-9-ylsulfanyl-butanamide

Systemtic Name:4-(pentylamino)-2-phenanthren-9-ylsulfanyl-butanamide
Openeye Name:4-(pentylamino)-2-(9-phenanthrylsulfanyl)butanamide
CAS Name:4-(pentylamino)-2-(9-phenanthrenylthio)butanamide
IUPAC Name:4-(pentylamino)-2-phenanthren-9-ylsulfanylbutanamide
Traditional Name:4-(amylamino)-2-(9-phenanthrylthio)butyramide
Formula: C23H28N2OS
MolecularWeight: 380.54622
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNCCC(C(=O)N)SC1=CC2=CC=CC=C2C3=CC=CC=C31


Isomeric SMILES

CCCCCNCCC(C(=O)N)SC1=CC2=CC=CC=C2C3=CC=CC=C31


InChI

InChI=1S/C23H28N2OS/c1-2-3-8-14-25-15-13-21(23(24)26)27-22-16-17-9-4-5-10-18(17)19-11-6-7-12-20(19)22/h4-7,9-12,16,21,25H,2-3,8,13-15H2,1H3,(H2,24,26)


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