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

Systemtic Name: 7-chloranyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-3-(3-propan-2-yloxypropyl)quinazolin-4-one Openeye Name: 7-chloro-3-(3-isopropoxypropyl)-2-[(E)-2-(5-nitro-2-furyl)vinyl]sulfanyl-quinazolin-4-one CAS Name: 7-chloro-2-[[(E)-2-(5-nitro-2-furanyl)ethenyl]thio]-3-(3-propan-2-yloxypropyl)-4-quinazolinone IUPAC Name: 7-chloro-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]sulfanyl-3-(3-propan-2-yloxypropyl)quinazolin-4-one Traditional Name: 7-chloro-3-(3-isopropoxypropyl)-2-[[(E)-2-(5-nitro-2-furyl)vinyl]thio]quinazolin-4-one Formula: C20H20ClN3O5S MolecularWeight: 449.9079

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC=CC3=CC=C(O3)[N+](=O)[O-]

Isomeric SMILES

CC(C)OCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1S/C=C/C3=CC=C(O3)[N+](=O)[O-]

InChI

InChI=1S/C20H20ClN3O5S/c1-13(2)28-10-3-9-23-19(25)16-6-4-14(21)12-17(16)22-20(23)30-11-8-15-5-7-18(29-15)24(26)27/h4-8,11-13H,3,9-10H2,1-2H3/b11-8+