N-[(E)-1-pyridin-2-ylethylideneamino]-1-azacyclotridecane-1-carbothioamide

Systemtic Name: N-[(E)-1-pyridin-2-ylethylideneamino]-1-azacyclotridecane-1-carbothioamide Openeye Name: N-[(E)-1-(2-pyridyl)ethylideneamino]-azacyclotridecane-1-carbothioamide CAS Name: N-[(E)-1-(2-pyridinyl)ethylideneamino]-azacyclotridecane-1-carbothioamide IUPAC Name: N-[(E)-1-pyridin-2-ylethylideneamino]-azacyclotridecane-1-carbothioamide Traditional Name: N-[(E)-1-(2-pyridyl)ethylideneamino]-azacyclotridecane-1-carbothioamide Formula: C20H32N4S MolecularWeight: 360.55988

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)N1CCCCCCCCCCCC1)C2=CC=CC=N2

Isomeric SMILES

C/C(=N\NC(=S)N1CCCCCCCCCCCC1)/C2=CC=CC=N2

InChI

InChI=1S/C20H32N4S/c1-18(19-14-10-11-15-21-19)22-23-20(25)24-16-12-8-6-4-2-3-5-7-9-13-17-24/h10-11,14-15H,2-9,12-13,16-17H2,1H3,(H,23,25)/b22-18+