N-(2-methoxyethyl)-2-(4-nitrophenyl)sulfanyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]ethanamide

Systemtic Name: N-(2-methoxyethyl)-2-(4-nitrophenyl)sulfanyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]ethanamide Openeye Name: N-(2-methoxyethyl)-2-(4-nitrophenyl)sulfanyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]acetamide CAS Name: N-(2-methoxyethyl)-2-[(4-nitrophenyl)thio]-N-[(4-oxo-1H-quinazolin-2-yl)methyl]acetamide IUPAC Name: N-(2-methoxyethyl)-2-(4-nitrophenyl)sulfanyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]acetamide Traditional Name: N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-(2-methoxyethyl)-2-[(4-nitrophenyl)thio]acetamide Formula: C20H20N4O5S MolecularWeight: 428.4616

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O5S/c1-29-11-10-23(12-18-21-17-5-3-2-4-16(17)20(26)22-18)19(25)13-30-15-8-6-14(7-9-15)24(27)28/h2-9H,10-13H2,1H3,(H,21,22,26)