3-ethyl-4-oxidanylidene-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-ethyl-4-oxidanylidene-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-ethyl-4-oxo-N-[(2-pyrazol-1-yl-3-pyridyl)methyl]-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-ethyl-4-oxo-N-[[2-(1-pyrazolyl)-3-pyridinyl]methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-ethyl-4-oxo-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-ethyl-4-keto-N-[(2-pyrazol-1-yl-3-pyridyl)methyl]-2-thioxo-1H-quinazoline-7-carboxamide Formula: C20H18N6O2S MolecularWeight: 406.46092

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=C(N=CC=C3)N4C=CC=N4)NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=C(N=CC=C3)N4C=CC=N4)NC1=S

InChI

InChI=1S/C20H18N6O2S/c1-2-25-19(28)15-7-6-13(11-16(15)24-20(25)29)18(27)22-12-14-5-3-8-21-17(14)26-10-4-9-23-26/h3-11H,2,12H2,1H3,(H,22,27)(H,24,29)