2-(furan-2-yl)-5-[4-[(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-7-yl)carbonyl]piperazin-1-yl]-1,3-oxazole-4-carbonitrile

Systemtic Name: 2-(furan-2-yl)-5-[4-[(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-7-yl)carbonyl]piperazin-1-yl]-1,3-oxazole-4-carbonitrile Openeye Name: 2-(2-furyl)-5-[4-(4-oxo-2-thioxo-1H-quinazoline-7-carbonyl)piperazin-1-yl]oxazole-4-carbonitrile CAS Name: 2-(2-furanyl)-5-[4-[oxo-(4-oxo-2-sulfanylidene-1H-quinazolin-7-yl)methyl]-1-piperazinyl]-4-oxazolecarbonitrile IUPAC Name: 2-(furan-2-yl)-5-[4-(4-oxo-2-sulfanylidene-1H-quinazoline-7-carbonyl)piperazin-1-yl]-1,3-oxazole-4-carbonitrile Traditional Name: 2-(2-furyl)-5-[4-(4-keto-2-thioxo-1H-quinazoline-7-carbonyl)piperazino]oxazole-4-carbonitrile Formula: C21H16N6O4S MolecularWeight: 448.45454

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(N=C(O2)C3=CC=CO3)C#N)C(=O)C4=CC5=C(C=C4)C(=O)NC(=S)N5

Isomeric SMILES

C1CN(CCN1C2=C(N=C(O2)C3=CC=CO3)C#N)C(=O)C4=CC5=C(C=C4)C(=O)NC(=S)N5

InChI

InChI=1S/C21H16N6O4S/c22-11-15-20(31-18(23-15)16-2-1-9-30-16)27-7-5-26(6-8-27)19(29)12-3-4-13-14(10-12)24-21(32)25-17(13)28/h1-4,9-10H,5-8H2,(H2,24,25,28,32)