2-[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(4-nitrophenyl)carbamoyl]ethanamide

Systemtic Name: 2-[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(4-nitrophenyl)carbamoyl]ethanamide Openeye Name: 2-[3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[(4-nitrophenyl)carbamoyl]acetamide CAS Name: 2-[[3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]thio]-N-[(4-nitroanilino)-oxomethyl]acetamide IUPAC Name: 2-[3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(4-nitrophenyl)carbamoyl]acetamide Traditional Name: 2-[[3-(2-furfuryl)-4-keto-quinazolin-2-yl]thio]-N-[(4-nitrophenyl)carbamoyl]acetamide Formula: C22H17N5O6S MolecularWeight: 479.46528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])CC4=CC=CO4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC(=O)NC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])CC4=CC=CO4

InChI

InChI=1S/C22H17N5O6S/c28-19(25-21(30)23-14-7-9-15(10-8-14)27(31)32)13-34-22-24-18-6-2-1-5-17(18)20(29)26(22)12-16-4-3-11-33-16/h1-11H,12-13H2,(H2,23,25,28,30)