N-(4-butylphenyl)-2-(1H-perimidin-2-ylsulfanyl)ethanamide

Systemtic Name: N-(4-butylphenyl)-2-(1H-perimidin-2-ylsulfanyl)ethanamide Openeye Name: N-(4-butylphenyl)-2-(1H-perimidin-2-ylsulfanyl)acetamide CAS Name: N-(4-butylphenyl)-2-(1H-perimidin-2-ylthio)acetamide IUPAC Name: N-(4-butylphenyl)-2-(1H-perimidin-2-ylsulfanyl)acetamide Traditional Name: N-(4-butylphenyl)-2-(1H-perimidin-2-ylthio)acetamide Formula: C23H23N3OS MolecularWeight: 389.51322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC4=C3C(=CC=C4)N2

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC4=C3C(=CC=C4)N2

InChI

InChI=1S/C23H23N3OS/c1-2-3-6-16-11-13-18(14-12-16)24-21(27)15-28-23-25-19-9-4-7-17-8-5-10-20(26-23)22(17)19/h4-5,7-14H,2-3,6,15H2,1H3,(H,24,27)(H,25,26)