3-butyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-butyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-quinazolin-4-one Openeye Name: 3-butyl-2-[(E)-2-(5-nitro-2-furyl)vinyl]sulfanyl-quinazolin-4-one CAS Name: 3-butyl-2-[[(E)-2-(5-nitro-2-furanyl)ethenyl]thio]-4-quinazolinone IUPAC Name: 3-butyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanylquinazolin-4-one Traditional Name: 3-butyl-2-[[(E)-2-(5-nitro-2-furyl)vinyl]thio]quinazolin-4-one Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SC=CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1S/C=C/C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O4S/c1-2-3-11-20-17(22)14-6-4-5-7-15(14)19-18(20)26-12-10-13-8-9-16(25-13)21(23)24/h4-10,12H,2-3,11H2,1H3/b12-10+