3-[(2-oxidanylideneazocan-1-yl)methyl]benzenecarbothioamide

Systemtic Name: 3-[(2-oxidanylideneazocan-1-yl)methyl]benzenecarbothioamide Openeye Name: 3-[(2-oxoazocan-1-yl)methyl]benzenecarbothioamide CAS Name: 3-[(2-oxo-1-azocanyl)methyl]benzenecarbothioamide IUPAC Name: 3-[(2-oxoazocan-1-yl)methyl]benzenecarbothioamide Traditional Name: 3-[(2-ketoazocan-1-yl)methyl]thiobenzamide Formula: C15H20N2OS MolecularWeight: 276.3971

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(C(=O)CC1)CC2=CC=CC(=C2)C(=S)N

Isomeric SMILES

C1CCCN(C(=O)CC1)CC2=CC=CC(=C2)C(=S)N

InChI

InChI=1S/C15H20N2OS/c16-15(19)13-7-5-6-12(10-13)11-17-9-4-2-1-3-8-14(17)18/h5-7,10H,1-4,8-9,11H2,(H2,16,19)