N-[2-[2-[(4-butylphenyl)carbamothioyl]hydrazinyl]-2-oxidanylidene-ethyl]-4-chloranyl-pyridine-2-carboxamide

Systemtic Name: N-[2-[2-[(4-butylphenyl)carbamothioyl]hydrazinyl]-2-oxidanylidene-ethyl]-4-chloranyl-pyridine-2-carboxamide Openeye Name: N-[2-[2-[(4-butylphenyl)carbamothioyl]hydrazino]-2-oxo-ethyl]-4-chloro-pyridine-2-carboxamide CAS Name: N-[2-[[(4-butylanilino)-sulfanylidenemethyl]hydrazo]-2-oxoethyl]-4-chloro-2-pyridinecarboxamide IUPAC Name: N-[2-[2-[(4-butylphenyl)carbamothioyl]hydrazinyl]-2-oxoethyl]-4-chloropyridine-2-carboxamide Traditional Name: N-[2-[N'-[(4-butylphenyl)thiocarbamoyl]hydrazino]-2-keto-ethyl]-4-chloro-picolinamide Formula: C19H22ClN5O2S MolecularWeight: 419.92828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)CNC(=O)C2=NC=CC(=C2)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)CNC(=O)C2=NC=CC(=C2)Cl

InChI

InChI=1S/C19H22ClN5O2S/c1-2-3-4-13-5-7-15(8-6-13)23-19(28)25-24-17(26)12-22-18(27)16-11-14(20)9-10-21-16/h5-11H,2-4,12H2,1H3,(H,22,27)(H,24,26)(H2,23,25,28)