N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide

Systemtic Name: N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Openeye Name: N-[4-methyl-5-(2-pyridyl)thiazol-2-yl]-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: N-[4-methyl-5-(2-pyridinyl)-2-thiazolyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide IUPAC Name: N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Traditional Name: 3-(4-keto-2-thioxo-1H-quinazolin-3-yl)-N-[4-methyl-5-(2-pyridyl)thiazol-2-yl]propionamide Formula: C20H17N5O2S2 MolecularWeight: 423.51128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CCN2C(=O)C3=CC=CC=C3NC2=S)C4=CC=CC=N4

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CCN2C(=O)C3=CC=CC=C3NC2=S)C4=CC=CC=N4

InChI

InChI=1S/C20H17N5O2S2/c1-12-17(15-8-4-5-10-21-15)29-19(22-12)24-16(26)9-11-25-18(27)13-6-2-3-7-14(13)23-20(25)28/h2-8,10H,9,11H2,1H3,(H,23,28)(H,22,24,26)