N-(furan-2-ylmethyl)-4-oxidanylidene-3-[[(2S)-oxolan-2-yl]methyl]-2-phenacylsulfanyl-quinazoline-7-carboxamide

Systemtic Name: N-(furan-2-ylmethyl)-4-oxidanylidene-3-[[(2S)-oxolan-2-yl]methyl]-2-phenacylsulfanyl-quinazoline-7-carboxamide Openeye Name: N-(2-furylmethyl)-4-oxo-2-phenacylsulfanyl-3-[[(2S)-tetrahydrofuran-2-yl]methyl]quinazoline-7-carboxamide CAS Name: N-(2-furanylmethyl)-4-oxo-3-[[(2S)-2-oxolanyl]methyl]-2-(phenacylthio)-7-quinazolinecarboxamide IUPAC Name: N-(furan-2-ylmethyl)-4-oxo-3-[[(2S)-oxolan-2-yl]methyl]-2-phenacylsulfanylquinazoline-7-carboxamide Traditional Name: N-(2-furfuryl)-4-keto-2-(phenacylthio)-3-[[(2S)-tetrahydrofuran-2-yl]methyl]quinazoline-7-carboxamide Formula: C27H25N3O5S MolecularWeight: 503.5695

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=C(C=C(C=C3)C(=O)NCC4=CC=CO4)N=C2SCC(=O)C5=CC=CC=C5

Isomeric SMILES

C1C[C@H](OC1)CN2C(=O)C3=C(C=C(C=C3)C(=O)NCC4=CC=CO4)N=C2SCC(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H25N3O5S/c31-24(18-6-2-1-3-7-18)17-36-27-29-23-14-19(25(32)28-15-20-8-4-12-34-20)10-11-22(23)26(33)30(27)16-21-9-5-13-35-21/h1-4,6-8,10-12,14,21H,5,9,13,15-17H2,(H,28,32)/t21-/m0/s1