2-[[(2S)-2-[3-(3-fluoranyl-4-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoyl]amino]thiophene-3-carboxamide

Systemtic Name: 2-[[(2S)-2-[3-(3-fluoranyl-4-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoyl]amino]thiophene-3-carboxamide Openeye Name: 2-[[(2S)-2-[3-(3-fluoro-4-methyl-phenyl)-4-oxo-quinazolin-2-yl]sulfanylpropanoyl]amino]thiophene-3-carboxamide CAS Name: 2-[[(2S)-2-[[3-(3-fluoro-4-methylphenyl)-4-oxo-2-quinazolinyl]thio]-1-oxopropyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[(2S)-2-[3-(3-fluoro-4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[(2S)-2-[[3-(3-fluoro-4-methyl-phenyl)-4-keto-quinazolin-2-yl]thio]propanoyl]amino]thiophene-3-carboxamide Formula: C23H19FN4O3S2 MolecularWeight: 482.550363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4=C(C=CS4)C(=O)N)F

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2S[C@@H](C)C(=O)NC4=C(C=CS4)C(=O)N)F

InChI

InChI=1S/C23H19FN4O3S2/c1-12-7-8-14(11-17(12)24)28-22(31)15-5-3-4-6-18(15)26-23(28)33-13(2)20(30)27-21-16(19(25)29)9-10-32-21/h3-11,13H,1-2H3,(H2,25,29)(H,27,30)/t13-/m0/s1