2-[4-(8-azanyloctyl)phenyl]benzenecarbothioamide

Systemtic Name: 2-[4-(8-azanyloctyl)phenyl]benzenecarbothioamide Openeye Name: 2-[4-(8-aminooctyl)phenyl]benzenecarbothioamide CAS Name: 2-[4-(8-aminooctyl)phenyl]benzenecarbothioamide IUPAC Name: 2-[4-(8-aminooctyl)phenyl]benzenecarbothioamide Traditional Name: 2-[4-(8-aminooctyl)phenyl]thiobenzamide Formula: C21H28N2S MolecularWeight: 340.52542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(C=C2)CCCCCCCCN)C(=S)N

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(C=C2)CCCCCCCCN)C(=S)N

InChI

InChI=1S/C21H28N2S/c22-16-8-4-2-1-3-5-9-17-12-14-18(15-13-17)19-10-6-7-11-20(19)21(23)24/h6-7,10-15H,1-5,8-9,16,22H2,(H2,23,24)