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

Systemtic Name: 7-chloranyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-3-propyl-quinazolin-4-one Openeye Name: 7-chloro-2-[(E)-2-(5-nitro-2-furyl)vinyl]sulfanyl-3-propyl-quinazolin-4-one CAS Name: 7-chloro-2-[[(E)-2-(5-nitro-2-furanyl)ethenyl]thio]-3-propyl-4-quinazolinone IUPAC Name: 7-chloro-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-3-propylquinazolin-4-one Traditional Name: 7-chloro-2-[[(E)-2-(5-nitro-2-furyl)vinyl]thio]-3-propyl-quinazolin-4-one Formula: C17H14ClN3O4S MolecularWeight: 391.82876

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC=CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1S/C=C/C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C17H14ClN3O4S/c1-2-8-20-16(22)13-5-3-11(18)10-14(13)19-17(20)26-9-7-12-4-6-15(25-12)21(23)24/h3-7,9-10H,2,8H2,1H3/b9-7+