2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-7-chloranyl-3-(3-propan-2-yloxypropyl)quinazolin-4-one

Systemtic Name: 2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-7-chloranyl-3-(3-propan-2-yloxypropyl)quinazolin-4-one Openeye Name: 2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-7-chloro-3-(3-isopropoxypropyl)quinazolin-4-one CAS Name: 2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methylthio]-7-chloro-3-(3-propan-2-yloxypropyl)-4-quinazolinone IUPAC Name: 2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-7-chloro-3-(3-propan-2-yloxypropyl)quinazolin-4-one Traditional Name: 2-[(3-tert-butyl-1,2,4-oxadiazol-5-yl)methylthio]-7-chloro-3-(3-isopropoxypropyl)quinazolin-4-one Formula: C21H27ClN4O3S MolecularWeight: 450.98208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=NC(=NO3)C(C)(C)C

Isomeric SMILES

CC(C)OCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=NC(=NO3)C(C)(C)C

InChI

InChI=1S/C21H27ClN4O3S/c1-13(2)28-10-6-9-26-18(27)15-8-7-14(22)11-16(15)23-20(26)30-12-17-24-19(25-29-17)21(3,4)5/h7-8,11,13H,6,9-10,12H2,1-5H3