N-(1,10-phenanthrolin-5-yl)-4-pyridin-2-yl-piperazine-1-carbothioamide

Systemtic Name: N-(1,10-phenanthrolin-5-yl)-4-pyridin-2-yl-piperazine-1-carbothioamide Openeye Name: N-(1,10-phenanthrolin-5-yl)-4-(2-pyridyl)piperazine-1-carbothioamide CAS Name: N-(1,10-phenanthrolin-5-yl)-4-(2-pyridinyl)-1-piperazinecarbothioamide IUPAC Name: N-(1,10-phenanthrolin-5-yl)-4-pyridin-2-ylpiperazine-1-carbothioamide Traditional Name: N-(1,10-phenanthrolin-5-yl)-4-(2-pyridyl)piperazine-1-carbothioamide Formula: C22H20N6S MolecularWeight: 400.4994

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=S)NC3=C4C=CC=NC4=C5C(=C3)C=CC=N5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=S)NC3=C4C=CC=NC4=C5C(=C3)C=CC=N5

InChI

InChI=1S/C22H20N6S/c29-22(28-13-11-27(12-14-28)19-7-1-2-8-23-19)26-18-15-16-5-3-9-24-20(16)21-17(18)6-4-10-25-21/h1-10,15H,11-14H2,(H,26,29)