N-[(E)-[4-[(5-chloranylpyridin-2-yl)amino]-4-oxidanylidene-butan-2-ylidene]amino]pyrazine-2-carboxamide

Systemtic Name: N-[(E)-[4-[(5-chloranylpyridin-2-yl)amino]-4-oxidanylidene-butan-2-ylidene]amino]pyrazine-2-carboxamide Openeye Name: N-[(E)-[3-[(5-chloro-2-pyridyl)amino]-1-methyl-3-oxo-propylidene]amino]pyrazine-2-carboxamide CAS Name: N-[(E)-[4-[(5-chloro-2-pyridinyl)amino]-4-oxobutan-2-ylidene]amino]-2-pyrazinecarboxamide IUPAC Name: N-[(E)-[4-[(5-chloropyridin-2-yl)amino]-4-oxobutan-2-ylidene]amino]pyrazine-2-carboxamide Traditional Name: N-[(E)-[3-[(5-chloro-2-pyridyl)amino]-3-keto-1-methyl-propylidene]amino]pyrazinamide Formula: C14H13ClN6O2 MolecularWeight: 332.74502

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NC=CN=C1)CC(=O)NC2=NC=C(C=C2)Cl

Isomeric SMILES

C/C(=N\NC(=O)C1=NC=CN=C1)/CC(=O)NC2=NC=C(C=C2)Cl

InChI

InChI=1S/C14H13ClN6O2/c1-9(20-21-14(23)11-8-16-4-5-17-11)6-13(22)19-12-3-2-10(15)7-18-12/h2-5,7-8H,6H2,1H3,(H,21,23)(H,18,19,22)/b20-9+