2-[7-chloranyl-3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(2S)-2-phenylbutyl]ethanamide

Systemtic Name: 2-[7-chloranyl-3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(2S)-2-phenylbutyl]ethanamide Openeye Name: 2-[7-chloro-3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[(2S)-2-phenylbutyl]acetamide CAS Name: 2-[[7-chloro-3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]thio]-N-[(2S)-2-phenylbutyl]acetamide IUPAC Name: 2-[7-chloro-3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(2S)-2-phenylbutyl]acetamide Traditional Name: 2-[[7-chloro-3-(2-furfuryl)-4-keto-quinazolin-2-yl]thio]-N-[(2S)-2-phenylbutyl]acetamide Formula: C25H24ClN3O3S MolecularWeight: 481.99436

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC3=CC=CO3)C4=CC=CC=C4

Isomeric SMILES

CC[C@H](CNC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC3=CC=CO3)C4=CC=CC=C4

InChI

InChI=1S/C25H24ClN3O3S/c1-2-17(18-7-4-3-5-8-18)14-27-23(30)16-33-25-28-22-13-19(26)10-11-21(22)24(31)29(25)15-20-9-6-12-32-20/h3-13,17H,2,14-16H2,1H3,(H,27,30)/t17-/m1/s1